data_6360 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6360 _Entry.Title ; IDENTIFICATION OF MINIMAL PEPTIDE SEQUENCE IN THE AMIDATED FRAGMENT 33-61 OF BOVINE a-HEMOGLBIN ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2004-10-18 _Entry.Accession_date 2004-10-18 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Alessandra Machado . . . 6360 2 Fernanda Silva . D. . 6360 3 Antonio Miranda . . . 6360 4 Sirlei Daffre . . . 6360 5 Mauricio Sforca . L. . 6360 6 Alberto Spisni . . . 6360 7 Thelma Pertinhez . A. . 6360 8 'M. Teresa' Miranda . M. . 6360 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6360 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 124 6360 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID . . . 2008-07-16 . update BMRB 'Updating non-standard residue' 6360 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6360 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 15850378 _Citation.Full_citation . _Citation.Title ; The micelle-bound structure of an antimicrobial peptide derived from the alpha-chain of bovine hemoglobin isolated from the tick Boophilus microplus. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full . _Citation.Journal_volume 44 _Citation.Journal_issue 17 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 6440 _Citation.Page_last 6451 _Citation.Year 2005 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Mauricio Sforca . L. . 6360 1 2 Alessandra Machado . . . 6360 1 3 Rita Figueredo . C. . 6360 1 4 Sergio Oyama . . Jr. 6360 1 5 Fernanda Silva . D. . 6360 1 6 Antonio Miranda . . . 6360 1 7 Sirlei Daffre . . . 6360 1 8 M. Miranda . Teresa . 6360 1 9 Alberto Spisni . . . 6360 1 10 Thelma Pertinhez . A. . 6360 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'antimicrobial peptide' 6360 1 'MINIMAL PEPTIDE SEQUENCE' 6360 1 'STRUCTURAL REQUIREMENTS' 6360 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_Hb40-61 _Assembly.Sf_category assembly _Assembly.Sf_framecode system_Hb40-61 _Assembly.Entry_ID 6360 _Assembly.ID 1 _Assembly.Name '40-61 bovine alpha-hemoglobin fragment' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 6360 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'fragment 40-61 amidated' 1 $Hb40-61a . . . native . . . . . 6360 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID '40-61 bovine alpha-hemoglobin fragment' system 6360 1 Hb40-61 abbreviation 6360 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'antimicrobial peptide' 6360 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Hb40-61a _Entity.Sf_category entity _Entity.Sf_framecode Hb40-61a _Entity.Entry_ID 6360 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'amidated fragment (40-61) of bovine alpha-hemoglobin' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; KTYFPHFDLSHGSAQVKGHG AKX ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 23 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 2412.7 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 1101 . "hemoglobin A alpha chain" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 2 no BMRB 16891 . HBA1 . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 3 no BMRB 16898 . HBA1 . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 4 no BMRB 25 . "hemoglobin A alpha chain" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 5 no BMRB 2707 . "hemoglobin A alpha chain" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 6 no BMRB 2709 . "hemoglobin A alpha chain" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 7 no BMRB 2868 . "hemoglobin A alpha chain" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 8 no BMRB 3442 . "hemoglobin A alpha chain" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 9 no BMRB 5809 . Hb_A . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 10 no BMRB 6048 . Hb3361a . . . . . 95.45 29 100.00 100.00 2.15e-05 . . . . 6360 1 11 no BMRB 6413 . 40-61_fragment . . . . . 95.45 22 100.00 100.00 2.30e-05 . . . . 6360 1 12 no BMRB 907 . "hemoglobin A alpha chain" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 13 no PDB 1A00 . "Hemoglobin (Val Beta1 Met, Trp Beta37 Tyr) Mutant" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 14 no PDB 1A01 . "Hemoglobin (Val Beta1 Met, Trp Beta37 Ala) Mutant" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 15 no PDB 1A0U . "Hemoglobin (Val Beta1 Met) Mutant" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 16 no PDB 1A0Z . "Hemoglobin (Val Beta1 Met) Mutant" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 17 no PDB 1A3N . "Deoxy Human Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 18 no PDB 1A9W . "Human Embryonic Gower Ii Carbonmonoxy Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 19 no PDB 1ABW . "Deoxy Rhb1.1 (Recombinant Hemoglobin)" . . . . . 90.91 283 100.00 100.00 1.94e-04 . . . . 6360 1 20 no PDB 1ABY . "Cyanomet Rhb1.1 (Recombinant Hemoglobin)" . . . . . 90.91 283 100.00 100.00 1.94e-04 . . . . 6360 1 21 no PDB 1B86 . "Human Deoxyhaemoglobin-2,3-Diphosphoglycerate Complex" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 22 no PDB 1BAB . "Hemoglobin Thionville: An Alpha-Chain Variant With A Substitution Of A Glutamate For Valine At Na-1 And Having An Acetylated Me" . . . . . 90.91 143 100.00 100.00 4.50e-05 . . . . 6360 1 23 no PDB 1BBB . "A Third Quaternary Structure Of Human Hemoglobin A At 1.7-angstroms Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 24 no PDB 1BIJ . "Crosslinked, Deoxy Human Hemoglobin A" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 25 no PDB 1BUW . "Crystal Structure Of S-Nitroso-Nitrosyl Human Hemoglobin A" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 26 no PDB 1BZ0 . "Hemoglobin A (Human, Deoxy, High Salt)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 27 no PDB 1BZ1 . "Hemoglobin (Alpha + Met) Variant" . . . . . 90.91 142 100.00 100.00 4.22e-05 . . . . 6360 1 28 no PDB 1BZZ . "Hemoglobin (Alpha V1m) Mutant" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 29 no PDB 1C7B . "Deoxy Rhb1.0 (Recombinant Hemoglobin)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 30 no PDB 1C7C . "Deoxy Rhb1.1 (Recombinant Hemoglobin)" . . . . . 90.91 283 100.00 100.00 1.94e-04 . . . . 6360 1 31 no PDB 1C7D . "Deoxy Rhb1.2 (Recombinant Hemoglobin)" . . . . . 90.91 284 100.00 100.00 2.00e-04 . . . . 6360 1 32 no PDB 1CLS . "Cross-Linked Human Hemoglobin Deoxy" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 33 no PDB 1CMY . "The Mutation Beta99 Asp-Tyr Stabilizes Y-A New, Composite Quaternary State Of Human Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 34 no PDB 1COH . "Structure Of Haemoglobin In The Deoxy Quaternary State With Ligand Bound At The Alpha Haems" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 35 no PDB 1DKE . "Ni Beta Heme Human Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 36 no PDB 1DXT . "High-Resolution X-Ray Study Of Deoxy Recombinant Human Hemoglobins Synthesized From Beta-Globins Having Mutated Amino Termini" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 37 no PDB 1DXU . "High-Resolution X-Ray Study Of Deoxy Recombinant Human Hemoglobins Synthesized From Beta-Globins Having Mutated Amino Termini" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 38 no PDB 1DXV . "High-resolution X-ray Study Of Deoxy Recombinant Human Hemoglobins Synthesized From Beta-globins Having Mutated Amino Termini" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 39 no PDB 1FDH . "Structure Of Human Foetal Deoxyhaemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 40 no PDB 1FN3 . "Crystal Structure Of Nickel Reconstituted Hemoglobin-A Case For Permanent, T-State Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 41 no PDB 1FSX . "The X-Ray Structure Determination Of Bovine Carbonmonoxy Hb At 2.1 A Resolution And Its Relationship To The Quaternary Structur" . . . . . 95.45 141 100.00 100.00 1.53e-05 . . . . 6360 1 42 no PDB 1G08 . "Carbonmonoxy Liganded Bovine Hemoglobin Ph 5.0" . . . . . 95.45 141 100.00 100.00 1.53e-05 . . . . 6360 1 43 no PDB 1G09 . "Carbonmonoxy Liganded Bovine Hemoglobin Ph 7.2" . . . . . 95.45 141 100.00 100.00 1.53e-05 . . . . 6360 1 44 no PDB 1G0A . "Carbonmonoxy Liganded Bovine Hemoglobin Ph 8.5" . . . . . 95.45 141 100.00 100.00 1.53e-05 . . . . 6360 1 45 no PDB 1G9V . "High Resolution Crystal Structure Of Deoxy Hemoglobin Complexed With A Potent Allosteric Effector" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 46 no PDB 1GBU . "Deoxy (Beta-(C93a,C112g)) Human Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 47 no PDB 1GBV . "(Alpha-Oxy, Beta-(C112g)deoxy) T-State Human Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 48 no PDB 1GLI . "Deoxyhemoglobin T38w (alpha Chains), V1g (alpha And Beta Chains)" . . . . . 90.91 141 100.00 100.00 4.55e-05 . . . . 6360 1 49 no PDB 1GZX . "Oxy T State Haemoglobin: Oxygen Bound At All Four Haems" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 50 no PDB 1HAB . "Crosslinked Haemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 51 no PDB 1HAC . "Crosslinked Haemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 52 no PDB 1HBA . "High-Resolution X-Ray Study Of Deoxyhemoglobin Rothschild 37beta Trp-> Arg: A Mutation That Creates An Intersubunit Chloride-Bi" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 53 no PDB 1HBB . "High-Resolution X-Ray Study Of Deoxyhemoglobin Rothschild 37beta Trp-> Arg: A Mutation That Creates An Intersubunit Chloride-Bi" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 54 no PDB 1HBS . "Refined Crystal Structure Of Deoxyhemoglobin S. I. Restrained Least-Squares Refinement At 3.0-Angstroms Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 55 no PDB 1HCO . "The Structure Of Human Carbonmonoxy Haemoglobin At 2.7 Angstroms Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 56 no PDB 1HDA . "A Novel Allosteric Mechanism In Haemoglobin. Structure Of Bovine Deoxyhaemoglobin, Absence Of Specific Chloride- Binding Sites " . . . . . 95.45 141 100.00 100.00 1.53e-05 . . . . 6360 1 57 no PDB 1HDB . "Analysis Of The Crystal Structure, Molecular Modeling And Infrared Spectroscopy Of The Distal Beta-Heme Pocket Valine67(E11)-Th" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 58 no PDB 1HGA . "High Resolution Crystal Structures And Comparisons Of T State Deoxyhaemoglobin And Two Liganded T-state Haemoglobins: T(alpha-o" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 59 no PDB 1HGB . "High Resolution Crystal Structures And Comparisons Of T State Deoxyhaemoglobin And Two Liganded T-State Haemoglobins: T(Alpha-O" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 60 no PDB 1HGC . "High Resolution Crystal Structures And Comparisons Of T State Deoxyhaemoglobin And Two Liganded T-state Haemoglobins: T(alpha-o" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 61 no PDB 1HHO . "Structure Of Human Oxyhaemoglobin At 2.1 Angstroms Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 62 no PDB 1IRD . "Crystal Structure Of Human Carbonmonoxy-Haemoglobin At 1.25 A Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 63 no PDB 1J3Y . "Direct Observation Of Photolysis-Induced Tertiary Structural Changes In Human Hemoglobin; Crystal Structure Of Alpha(Fe)-Beta(N" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 64 no PDB 1J3Z . "Direct Observation Of Photolysis-Induced Tertiary Structural Changes In Human Haemoglobin; Crystal Structure Of Alpha(Fe-Co)-Be" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 65 no PDB 1J40 . "Direct Observation Of Photolysis-Induced Tertiary Structural Changes In Human Haemoglobin; Crystal Structure Of Alpha(Ni)-Beta(" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 66 no PDB 1J41 . "Direct Observation Of Photolysis-Induced Tertiary Structural Changes In Human Haemoglobin; Crystal Structure Of Alpha(Ni)-Beta(" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 67 no PDB 1J7W . "Crystal Structure Of Deoxy Hbbetayq, A Site Directed Mutant Of Hba" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 68 no PDB 1JY7 . "The Structure Of Human Methemoglobin. The Variation Of A Theme" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 69 no PDB 1K0Y . "X-ray Crystallographic Analyses Of Symmetrical Allosteric Effectors Of Hemoglobin. Compounds Designed To Link Primary And Secon" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 70 no PDB 1K1K . "Structure Of Mutant Human Carbonmonoxyhemoglobin C (beta E6k) At 2.0 Angstrom Resolution In Phosphate Buffer." . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 71 no PDB 1KD2 . "Crystal Structure Of Human Deoxyhemoglobin In Absence Of Any Anions" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 72 no PDB 1LFL . "Deoxy Hemoglobin (90% Relative Humidity)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 73 no PDB 1LFQ . "Oxy Hemoglobin (93% Relative Humidity)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 74 no PDB 1LFT . "Oxy Hemoglobin (90% Relative Humidity)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 75 no PDB 1LFV . "Oxy Hemoglobin (88% Relative Humidity)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 76 no PDB 1LFY . "Oxy Hemoglobin (84% Relative Humidity)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 77 no PDB 1LFZ . "Oxy Hemoglobin (25% Methanol)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 78 no PDB 1LJW . "Crystal Structure Of Human Carbonmonoxy Hemoglobin At 2.16 A: A Snapshot Of The Allosteric Transition" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 79 no PDB 1M9P . "Crystalline Human Carbonmonoxy Hemoglobin C Exhibits The R2 Quaternary State At Neutral Ph In The Presence Of Polyethylene Glyc" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 80 no PDB 1MKO . "A Fourth Quaternary Structure Of Human Hemoglobin A At 2.18 A Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 81 no PDB 1NEJ . "Crystalline Human Carbonmonoxy Hemoglobin S (liganded Sickle Cell Hemoglobin) Exhibits The R2 Quaternary State At Neutral Ph In" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 82 no PDB 1NIH . "Structure Of Deoxy-Quaternary Haemoglobin With Liganded Beta Subunits" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 83 no PDB 1NQP . "Crystal Structure Of Human Hemoglobin E At 1.73 A Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 84 no PDB 1O1K . "Deoxy Hemoglobin (A,C:v1m; B,D:v1m,V67w)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 85 no PDB 1O1N . "Deoxy Hemoglobin (A-Glyglygly-C:v1m,L29w; B,D:v1m)" . . . . . 90.91 285 100.00 100.00 2.22e-04 . . . . 6360 1 86 no PDB 1O1O . "Deoxy Hemoglobin (A,C:v1m,V62l; B,D:v1m,V67l)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 87 no PDB 1O1P . "Deoxy Hemoglobin (A-Gly-C:v1m; B,D:v1m,C93a,N108k)" . . . . . 90.91 283 100.00 100.00 1.94e-04 . . . . 6360 1 88 no PDB 1QSH . "Magnesium(Ii)-And Zinc(Ii)-Protoporphyrin Ix's Stabilize The Lowest Oxygen Affinity State Of Human Hemoglobin Even More Strongl" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 89 no PDB 1QSI . "Magnesium(Ii)-And Zinc(Ii)-Protoporphyrin Ix's Stabilize The Lowest Oxygen Affinity State Of Human Hemoglobin Even More Strongl" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 90 no PDB 1QXD . "Structural Basis For The Potent Antisickling Effect Of A Novel Class Of 5-Membered Heterocyclic Aldehydic Compounds" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 91 no PDB 1QXE . "Structural Basis For The Potent Antisickling Effect Of A Novel Class Of 5-Membered Heterocyclic Aldehydic Compounds" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 92 no PDB 1R1X . "Crystal Structure Of Oxy-Human Hemoglobin Bassett At 2.15 Angstrom" . . . . . 90.91 141 100.00 100.00 4.12e-05 . . . . 6360 1 93 no PDB 1R1Y . "Crystal Structure Of Deoxy-Human Hemoglobin Bassett At 1.8 Angstrom" . . . . . 90.91 141 100.00 100.00 4.12e-05 . . . . 6360 1 94 no PDB 1RPS . "Crystallographic Analysis Of The Interaction Of Nitric Oxide With Quaternary-T Human Hemoglobin. Hemoglobin Exposed To No Under" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 95 no PDB 1RQ3 . "Crystallographic Analysis Of The Interaction Of Nitric Oxide With Quaternary-T Human Deoxyhemoglobin, Deoxyhemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 96 no PDB 1RQ4 . "Crystallographic Analysis Of The Interaction Of Nitric Oxide With Quaternary-T Human Hemoglobin, Hemoglobin Exposed To No Under" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 97 no PDB 1RQA . "Crystallographic Analysis Of The Interaction Of Nitric Oxide With Quaternary-T Human Hemoglobin. Beta W73e Hemoglobin Exposed T" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 98 no PDB 1RVW . "R State Human Hemoglobin [alpha V96w], Carbonmonoxy" . . . . . 90.91 141 100.00 100.00 4.59e-05 . . . . 6360 1 99 no PDB 1SDK . "Cross-linked, Carbonmonoxy Hemoglobin A" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 100 no PDB 1SDL . "Cross-Linked, Carbonmonoxy Hemoglobin A" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 101 no PDB 1SHR . "Crystal Structure Of Ferrocyanide Bound Human Hemoglobin A2 At 1.88a Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 102 no PDB 1SI4 . "Crystal Structure Of Human Hemoglobin A2 (In R2 State) At 2.2 A Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 103 no PDB 1THB . "Refinement Of A Partially Oxygenated T State Haemoglobin At 1.5 Angstroms Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 104 no PDB 1UIW . "Crystal Structures Of Unliganded And Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82beta1 And Lys 82beta" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 105 no PDB 1VWT . "T State Human Hemoglobin [alpha V96w], Alpha Aquomet, Beta Deoxy" . . . . . 90.91 141 100.00 100.00 4.59e-05 . . . . 6360 1 106 no PDB 1XXT . "The T-To-T High Transitions In Human Hemoglobin: Wild-Type Deoxy Hb A (Low Salt, One Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 107 no PDB 1XY0 . "T-To-Thigh Transitions In Human Hemoglobin: Alphak40g Deoxy Low-Salt" . . . . . 86.36 141 100.00 100.00 2.12e-04 . . . . 6360 1 108 no PDB 1XZ2 . "Wild-Type Hemoglobin Deoxy No-Salt" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 109 no PDB 1XZ5 . "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphal91a Deoxy Low-Salt" . . . . . 90.91 141 100.00 100.00 4.37e-05 . . . . 6360 1 110 no PDB 1XZ7 . "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphar92a Deoxy Low-Salt" . . . . . 90.91 141 100.00 100.00 4.20e-05 . . . . 6360 1 111 no PDB 1XZU . "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphad94g Deoxy Low-Salt" . . . . . 90.91 141 100.00 100.00 4.64e-05 . . . . 6360 1 112 no PDB 1XZV . "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphap95a Deoxy Low-Salt" . . . . . 90.91 141 100.00 100.00 3.96e-05 . . . . 6360 1 113 no PDB 1Y01 . "Crystal Structure Of Ahsp Bound To Fe(Ii) Alpha-Hemoglobin" . . . . . 90.91 142 100.00 100.00 4.22e-05 . . . . 6360 1 114 no PDB 1Y09 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Alphan97a Deoxy Low-Salt" . . . . . 90.91 141 100.00 100.00 4.33e-05 . . . . 6360 1 115 no PDB 1Y0A . "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphay140a Deoxy Low-Salt" . . . . . 90.91 141 100.00 100.00 4.04e-05 . . . . 6360 1 116 no PDB 1Y0C . "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Alphay140f Deoxy Low-Salt" . . . . . 90.91 141 100.00 100.00 4.41e-05 . . . . 6360 1 117 no PDB 1Y0D . "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Desarg141alpha Deoxy Low-Salt" . . . . . 90.91 140 100.00 100.00 4.57e-05 . . . . 6360 1 118 no PDB 1Y0T . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betav1m Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 119 no PDB 1Y0W . "T-To-Thigh Quaternary Transitions In Human Hemoglobin: Betav1m Deoxy Low-Salt (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 120 no PDB 1Y22 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betav33a Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 121 no PDB 1Y2Z . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betav34g Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 122 no PDB 1Y31 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betay35a Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 123 no PDB 1Y35 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betay35f Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 124 no PDB 1Y45 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betap36a Deoxy Low-Salt (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 125 no PDB 1Y46 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37y Deoxy Low-Salt (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 126 no PDB 1Y4B . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37h Deoxy Low-Salt (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 127 no PDB 1Y4F . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37a Deoxy Low-Salt (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 128 no PDB 1Y4G . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37g Deoxy Low-Salt (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 129 no PDB 1Y4P . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37e Deoxy Low-Salt (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 130 no PDB 1Y4Q . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaf42a Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 131 no PDB 1Y4R . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaf45a Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 132 no PDB 1Y4V . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betac93a Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 133 no PDB 1Y5F . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betal96a Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 134 no PDB 1Y5J . "T-to-t(high) Quaternary Transitions In Human Hemoglobin: Betah97a Deoxy Low-salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 135 no PDB 1Y5K . "T-to-t(high) Quaternary Transitions In Human Hemoglobin: Betad99a Deoxy Low-salt (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 136 no PDB 1Y7C . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betap100a Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 137 no PDB 1Y7D . "T-to-t(high) Quaternary Transitions In Human Hemoglobin: Betap100g Deoxy Low-salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 138 no PDB 1Y7G . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betan102a Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 139 no PDB 1Y7Z . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betan108a Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 140 no PDB 1Y83 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betay145g Deoxy Low-Salt (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 141 no PDB 1Y85 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Deshis146beta Deoxy Low-Salt" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 142 no PDB 1Y8W . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Alphar92a Oxy (2mm Ihp, 20% Peg) (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.20e-05 . . . . 6360 1 143 no PDB 1YDZ . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Alphay140f Oxy (2mm Ihp, 20% Peg) (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.41e-05 . . . . 6360 1 144 no PDB 1YE0 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betav33a Oxy (2mm Ihp, 20% Peg) (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 145 no PDB 1YE1 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betay35a Oxy (2mm Ihp, 20% Peg) (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 146 no PDB 1YE2 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betay35f Oxy (2mm Ihp, 20% Peg) (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 147 no PDB 1YEN . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betap36a Oxy (2mm Ihp, 20% Peg) (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 148 no PDB 1YEO . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37a Oxy (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 149 no PDB 1YEQ . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37y Oxy (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 150 no PDB 1YEU . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37g Oxy (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 151 no PDB 1YEV . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37e Oxy (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 152 no PDB 1YFF . "Structure Of Human Carbonmonoxyhemoglobin C (beta E6k): Two Quaternary States (r2 And R3) In One Crystal" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 153 no PDB 1YG5 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betaw37h Oxy (2mm Ihp, 20% Peg) (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 154 no PDB 1YGD . "T-to-t(high) Quaternary Transitions In Human Hemoglobin: Betaw37e Alpha Zinc Beta Oxy (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 155 no PDB 1YGF . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betah97a Oxy (2mm Ihp, 20% Peg) (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 156 no PDB 1YH9 . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Hba Oxy (2mm Ihp, 20% Peg) (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 157 no PDB 1YHE . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Hba Oxy (5.0mm Ihp, 20% Peg) (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 158 no PDB 1YHR . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Hba Oxy (10.0mm Ihp, 20% Peg) (10 Test Sets)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 159 no PDB 1YIE . "T-to-thigh Quaternary Transitions In Human Hemoglobin: Betaw37a Oxy (2.2mm Ihp, 13% Peg) (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 160 no PDB 1YIH . "T-To-T(High) Quaternary Transitions In Human Hemoglobin: Betap100a Oxy (2.2mm Ihp, 20% Peg) (1 Test Set)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 161 no PDB 1YVQ . "The Low Salt (Peg) Crystal Structure Of Co Hemoglobin E (Betae26k) Approaching Physiological Ph (Ph 7.5)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 162 no PDB 1YVT . "The High Salt (Phosphate) Crystal Structure Of Co Hemoglobin E (Glu26lys) At Physiological Ph (Ph 7.35)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 163 no PDB 1YZI . "A Novel Quaternary Structure Of Human Carbonmonoxy Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 164 no PDB 1Z8U . "Crystal Structure Of Oxidized Alpha Hemoglobin Bound To Ahsp" . . . . . 90.91 142 100.00 100.00 4.22e-05 . . . . 6360 1 165 no PDB 2D5Z . "Crystal Structure Of T-State Human Hemoglobin Complexed With Three L35 Molecules" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 166 no PDB 2D60 . "Crystal Structure Of Deoxy Human Hemoglobin Complexed With Two L35 Molecules" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 167 no PDB 2DN1 . "1.25a Resolution Crystal Structure Of Human Hemoglobin In The Oxy Form" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 168 no PDB 2DN2 . "1.25a Resolution Crystal Structure Of Human Hemoglobin In The Deoxy Form" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 169 no PDB 2DN3 . "1.25a Resolution Crystal Structure Of Human Hemoglobin In The Carbonmonoxy Form" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 170 no PDB 2DXM . "Neutron Structure Analysis Of Deoxy Human Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 171 no PDB 2H35 . "Solution Structure Of Human Normal Adult Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 172 no PDB 2HBC . "High Resolution X-ray Structures Of Myoglobin-and Hemoglobin-alkyl Isocyanide Complexes" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 173 no PDB 2HBD . "High Resolution X-Ray Structures Of Myoglobin-And Hemoglobin-Alkyl Isocyanide Complexes" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 174 no PDB 2HBE . "High Resolution X-Ray Structures Of Myoglobin-And Hemoglobin-Alkyl Isocyanide Complexes" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 175 no PDB 2HBF . "High Resolution X-Ray Structures Of Myoglobin-And Hemoglobin-Alkyl Isocyanide Complexes" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 176 no PDB 2HBS . "The High Resolution Crystal Structure Of Deoxyhemoglobin S" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 177 no PDB 2HCO . "The Structure Of Human Carbonmonoxy Haemoglobin At 2.7 Angstroms Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 178 no PDB 2HHB . "The Crystal Structure Of Human Deoxyhaemoglobin At 1.74 Angstroms Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 179 no PDB 2HHD . "Oxygen Affinity Modulation By The N-Termini Of The Beta- Chains In Human And Bovine Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 180 no PDB 2HHE . "Oxygen Affinity Modulation By The N-Termini Of The Beta Chains In Human And Bovine Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 181 no PDB 2M6Z . "Refined Solution Structure Of Human Adult Hemoglobin In The Carbonmonoxy Form" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 182 no PDB 2QSP . "Bovine Hemoglobin At Ph 5.7" . . . . . 95.45 141 100.00 100.00 1.53e-05 . . . . 6360 1 183 no PDB 2QSS . "Bovine Hemoglobin At Ph 6.3" . . . . . 95.45 141 100.00 100.00 1.53e-05 . . . . 6360 1 184 no PDB 2QU0 . "Crystal Structure Determination Of Sheep Methemoglobin At 2.7 Angstrom Resolution" . . . . . 90.91 141 100.00 100.00 5.22e-05 . . . . 6360 1 185 no PDB 2RI4 . "Crystal Structure Determination Of Goat Methemoglobin At 2.7 Angstrom" . . . . . 90.91 141 100.00 100.00 5.22e-05 . . . . 6360 1 186 no PDB 2W6V . "Structure Of Human Deoxy Hemoglobin A In Complex With Xenon" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 187 no PDB 2YRS . "Human Hemoglobin D Los Angeles: Crystal Structure" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 188 no PDB 3B75 . "Crystal Structure Of Glycated Human Haemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 189 no PDB 3CIU . "Site-Selective Glycosylation Of Cysteine-93 Beta On The Surface Of Bovine Hemoglobin And Its Application As A Novel Oxygen Ther" . . . . . 95.45 141 100.00 100.00 1.53e-05 . . . . 6360 1 190 no PDB 3CY5 . "Crystal Structure Determination Of Buffalo (Bubalus Bubalis) Hemoglobin At 2 Angstrom Resolution" . . . . . 95.45 141 100.00 100.00 1.62e-05 . . . . 6360 1 191 no PDB 3D17 . "A Triply Ligated Crystal Structure Of Relaxed State Human Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 192 no PDB 3D1A . "Crystal Structure Determination Of Goat Hemoglobin At 2.61 Angstrom Resolution" . . . . . 90.91 142 100.00 100.00 5.10e-05 . . . . 6360 1 193 no PDB 3D7O . "Human Hemoglobin, Nitrogen Dioxide Anion Modified" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 194 no PDB 3DUT . "The High Salt (Phosphate) Crystal Structure Of Deoxy Hemoglobin E (Glu26lys) At Physiological Ph (Ph 7.35)" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 195 no PDB 3EU1 . "Crystal Structure Determination Of Goat Hemoglobin (Capra Hircus) At 3 Angstrom Resolution" . . . . . 90.91 141 100.00 100.00 5.22e-05 . . . . 6360 1 196 no PDB 3HHB . "The Crystal Structure Of Human Deoxyhaemoglobin At 1.74 Angstroms Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 197 no PDB 3HXN . "The Structure Of Human Carbonmonoxyhemoglobin Complex To Ihp At 2.0 Angstrons Resolution." . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 198 no PDB 3IA3 . "A Cis-Proline In Alpha-Hemoglobin Stabilizing Protein Directs The Structural Reorganization Of Alpha-Hemoglobin" . . . . . 90.91 145 100.00 100.00 5.09e-05 . . . . 6360 1 199 no PDB 3IC0 . "Crystal Structure Of Liganded Hemoglobin In Complex With A Potent Antisickling Agent, Inn-298" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 200 no PDB 3IC2 . "Crystal Structure Of Liganded Hemoglobin In Complex With A Potent Antisickling Agent, Inn-266" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 201 no PDB 3KMF . "Room Temperature Time-Of-Flight Neutron Diffraction Study Of Deoxy Human Normal Adult Hemoglobin" . . . . . 90.91 141 100.00 100.00 4.64e-05 . . . . 6360 1 202 no PDB 3NL7 . "Human Hemoglobin A Mutant Beta H63w Carbonmonoxy-Form" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 203 no PDB 3ODQ . "Structure Of A Crystal Form Of Human Methemoglobin Indicative Of Fiber Formation" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 204 no PDB 3ONZ . "Human Tetrameric Hemoglobin: Proximal Nitrite Ligand At Beta" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 205 no PDB 3OO4 . "R-State Human Hemoglobin: Nitriheme Modified At Alpha" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 206 no PDB 3OO5 . "R-State Human Hemoglobin: Nitriheme Modified" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 207 no PDB 3OVU . "Crystal Structure Of Human Alpha-Haemoglobin Complexed With Ahsp And The First Neat Domain Of Isdh From Staphylococcus Aureus" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 208 no PDB 3P5Q . "Ferric R-State Human Aquomethemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 209 no PDB 3PI8 . "Site-Specific Glycosylation Of Hemoglobin Utilizing Oxime Ligation Chemistry As A Viable Alternative To Pegylation" . . . . . 95.45 141 100.00 100.00 1.53e-05 . . . . 6360 1 210 no PDB 3PI9 . "Site-Specific Glycosylation Of Hemoglobin Utilizing Oxime Ligation Chemistry As A Viable Alternative To Pegylation" . . . . . 95.45 141 100.00 100.00 1.53e-05 . . . . 6360 1 211 no PDB 3PIA . "Site-Specific Glycosylation Of Hemoglobin Utilizing Oxime Ligation Chemistry As A Viable Alternative To Pegylation" . . . . . 95.45 141 100.00 100.00 1.53e-05 . . . . 6360 1 212 no PDB 3QJC . "Human Hemoglobin A Mutant Beta H63l Carbonmonoxy-Form" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 213 no PDB 3QJE . "Human Hemoglobin A Mutant Beta H63l Deoxy-Form" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 214 no PDB 3R5I . "Crystal Structure Of Liganded Hemoglobin Complexed With A Potent Antisickling Agent, Inn-312" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 215 no PDB 3S48 . "Human Alpha-haemoglobin Complexed With The First Neat Domain Of Isdh From Staphylococcus Aureus" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 216 no PDB 3S65 . "Structures And Oxygen Affinities Of Crystalline Human Hemoglobin C (Beta6 Lys) In The R2 Quaternary Structures" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 217 no PDB 3S66 . "Structures And Oxygen Affinities Of Crystalline Human Hemoglobin C (Beta6 Lys) In The R Quaternary Structures" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 218 no PDB 3SZK . "Crystal Structure Of Human Methaemoglobin Complexed With The First Neat Domain Of Isdh From Staphylococcus Aureus" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 219 no PDB 3WCP . "Deoxyhemoglobin Sh-drug Complex" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 220 no PDB 3WHM . "Structure Of Hemoglobin Complex With 18-crown-6" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 221 no PDB 4FC3 . "Crystal Structure Of Human Methaemoglobin Complexed With The Second Neat Domain Of Isdh From Staphylococcus Aureus" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 222 no PDB 4HHB . "The Crystal Structure Of Human Deoxyhaemoglobin At 1.74 Angstroms Resolution" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 223 no PDB 4IJ2 . "Human Methemoglobin In Complex With The Second And Third Neat Domains Of Isdh From Staphylococcus Aureus" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 224 no PDB 4L7Y . "Deoxygenated Hb In Complex With The Allosteric Effectors, Irl2500 And 2,3-dpg" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 225 no PDB 4M4A . "Human Hemoglobin Nitromethane Modified" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 226 no PDB 4M4B . "Human Hemoglobin Nitroethane Modified" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 227 no PDB 4MQC . "Carbonmonoxy Structure Of Hemoglobin Evans Alphav62mbetawt" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 228 no PDB 4MQG . "Structure Of Carbonmonoxy Adult Hemoglobin Bristol-alesha Alphawtbetav67m" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 229 no PDB 4MQH . "Structure Of Aquomet Hemoglobin Evans Alphav62mbetawt" . . . . . 90.91 139 100.00 100.00 4.16e-05 . . . . 6360 1 230 no PDB 4MQI . "Structure Of Aquomet Hemoglobin Bristol-alesha Alphawtbetav67m" . . . . . 90.91 140 100.00 100.00 4.57e-05 . . . . 6360 1 231 no PDB 4MQJ . "Structure Of Wild-type Fetal Human Hemoglobin Hbf" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 232 no PDB 4MQK . "Carbonmonoxy Structure Of The Human Fetal Hemoglobin Mutant Hbf Toms River Alphawtgammav67m" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 233 no PDB 4N7N . "Capturing The Haemoglobin Allosteric Transition In A Single Crystal Form; Crystal Structure Of Full-liganded Human Haemoglobin " . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 234 no PDB 4N7O . "Capturing The Haemoglobin Allosteric Transition In A Single Crystal Form; Crystal Structure Of Half-liganded Human Haemoglobin " . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 235 no PDB 4N7P . "Capturing The Haemoglobin Allosteric Transition In A Single Crystal Form; Crystal Structure Of Half-liganded Human Haemoglobin " . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 236 no PDB 4N8T . "Human Hemoglobin Nitric Oxide Adduct" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 237 no PDB 4NI0 . "Quaternary R3 Co-liganded Hemoglobin Structure In Complex With A Thiol Containing Compound" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 238 no PDB 4NI1 . "Qauternary R Co-liganded Hemoglobin Structure In Complex With A Thiol Containing Compound" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 239 no PDB 4WJG . "Structure Of T. Brucei Haptoglobin-hemoglobin Receptor Binding To Human Haptoglobin-hemoglobin" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 240 no PDB 6HBW . "Crystal Structure Of Deoxy-human Hemoglobin Beta6 Glu->trp" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 241 no DBJ BAD97112 . "alpha 2 globin variant [Homo sapiens]" . . . . . 90.91 142 100.00 100.00 4.80e-05 . . . . 6360 1 242 no DBJ BAJ20323 . "hemoglobin, alpha 1 [synthetic construct]" . . . . . 90.91 142 100.00 100.00 4.22e-05 . . . . 6360 1 243 no EMBL CAA23748 . "alpha globin [Homo sapiens]" . . . . . 90.91 142 100.00 100.00 4.22e-05 . . . . 6360 1 244 no EMBL CAA23749 . "alpha globin [Homo sapiens]" . . . . . 68.18 128 100.00 100.00 7.53e-01 . . . . 6360 1 245 no EMBL CAA23750 . "alpha 1 globin [Homo sapiens]" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 246 no EMBL CAA23752 . "hemoglobin alpha chain [Homo sapiens]" . . . . . 90.91 142 100.00 100.00 4.22e-05 . . . . 6360 1 247 no EMBL CAA23774 . "alpha-2-globin [Homo sapiens]" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 248 no GB AAA30909 . "alpha-i globin [Capra hircus]" . . . . . 90.91 142 100.00 100.00 5.10e-05 . . . . 6360 1 249 no GB AAA30910 . "alpha-ii globin [Capra hircus]" . . . . . 90.91 142 100.00 100.00 5.41e-05 . . . . 6360 1 250 no GB AAA36844 . "alpha-globin [Macaca mulatta]" . . . . . 90.91 142 100.00 100.00 5.75e-05 . . . . 6360 1 251 no GB AAA52631 . "alpha-globin, partial [Homo sapiens]" . . . . . 77.27 28 100.00 100.00 1.11e-02 . . . . 6360 1 252 no GB AAB22948 . "hemoglobin AA phenotype alpha 1 chain [Bubalus bubalis=river buffaloes, Peptide, 142 aa]" . . . . . 95.45 142 100.00 100.00 2.05e-05 . . . . 6360 1 253 no PIR A24693 . "hemoglobin alpha-1 chain - stump-tailed macaque" . . . . . 90.91 141 100.00 100.00 5.60e-05 . . . . 6360 1 254 no PIR HAMQR . "hemoglobin alpha-2 chain - rhesus macaque" . . . . . 90.91 142 100.00 100.00 5.75e-05 . . . . 6360 1 255 no PRF 0907233A . "hemoglobin alpha" . . . . . 90.91 141 100.00 100.00 4.50e-05 . . . . 6360 1 256 no PRF 1004268B . "hemoglobin alphaII" . . . . . 95.45 141 100.00 100.00 1.61e-05 . . . . 6360 1 257 no PRF 1004272A . "hemoglobin alpha" . . . . . 90.91 141 100.00 100.00 5.94e-05 . . . . 6360 1 258 no PRF 1004272B . "hemoglobin alpha" . . . . . 90.91 141 100.00 100.00 5.33e-05 . . . . 6360 1 259 no PRF 1509322A . "hemoglobin alpha" . . . . . 90.91 141 100.00 100.00 5.55e-05 . . . . 6360 1 260 no REF NP_000508 . "hemoglobin subunit alpha [Homo sapiens]" . . . . . 90.91 142 100.00 100.00 4.22e-05 . . . . 6360 1 261 no REF NP_000549 . "hemoglobin subunit alpha [Homo sapiens]" . . . . . 90.91 142 100.00 100.00 4.22e-05 . . . . 6360 1 262 no REF NP_001036091 . "hemoglobin subunit alpha [Pan troglodytes]" . . . . . 90.91 142 100.00 100.00 4.22e-05 . . . . 6360 1 263 no REF NP_001036092 . "hemoglobin subunit alpha [Pan troglodytes]" . . . . . 90.91 142 100.00 100.00 4.22e-05 . . . . 6360 1 264 no REF NP_001038189 . "hemoglobin subunit theta-1 [Macaca mulatta]" . . . . . 90.91 142 100.00 100.00 5.75e-05 . . . . 6360 1 265 no SP P01923 . "RecName: Full=Hemoglobin subunit alpha; AltName: Full=Alpha-globin; AltName: Full=Hemoglobin alpha chain [Gorilla gorilla goril" . . . . . 90.91 141 100.00 100.00 4.68e-05 . . . . 6360 1 266 no SP P01924 . "RecName: Full=Hemoglobin subunit alpha; AltName: Full=Alpha-globin; AltName: Full=Hemoglobin alpha chain [Semnopithecus entellu" . . . . . 90.91 141 100.00 100.00 6.06e-05 . . . . 6360 1 267 no SP P01926 . "RecName: Full=Hemoglobin subunit alpha; AltName: Full=Alpha-globin; AltName: Full=Hemoglobin alpha chain [Chlorocebus aethiops]" . . . . . 90.91 142 100.00 100.00 5.75e-05 . . . . 6360 1 268 no SP P01928 . "RecName: Full=Hemoglobin subunit alpha; AltName: Full=Alpha-globin; AltName: Full=Hemoglobin alpha chain [Sapajus apella]" . . . . . 90.91 142 100.00 100.00 5.86e-05 . . . . 6360 1 269 no SP P01929 . "RecName: Full=Hemoglobin subunit alpha; AltName: Full=Alpha-globin; AltName: Full=Hemoglobin alpha chain [Saguinus fuscicollis]" . . . . . 90.91 141 100.00 100.00 5.33e-05 . . . . 6360 1 270 no TPG DAA15749 . "TPA: hemoglobin subunit alpha [Bos taurus]" . . . . . 95.45 142 100.00 100.00 1.43e-05 . . . . 6360 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'amidated fragment (40-61) of bovine alpha-hemoglobin' common 6360 1 Hb40-61a abbreviation 6360 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . LYS . 6360 1 2 . THR . 6360 1 3 . TYR . 6360 1 4 . PHE . 6360 1 5 . PRO . 6360 1 6 . HIS . 6360 1 7 . PHE . 6360 1 8 . ASP . 6360 1 9 . LEU . 6360 1 10 . SER . 6360 1 11 . HIS . 6360 1 12 . GLY . 6360 1 13 . SER . 6360 1 14 . ALA . 6360 1 15 . GLN . 6360 1 16 . VAL . 6360 1 17 . LYS . 6360 1 18 . GLY . 6360 1 19 . HIS . 6360 1 20 . GLY . 6360 1 21 . ALA . 6360 1 22 . LYS . 6360 1 23 . NH2 . 6360 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . LYS 1 1 6360 1 . THR 2 2 6360 1 . TYR 3 3 6360 1 . PHE 4 4 6360 1 . PRO 5 5 6360 1 . HIS 6 6 6360 1 . PHE 7 7 6360 1 . ASP 8 8 6360 1 . LEU 9 9 6360 1 . SER 10 10 6360 1 . HIS 11 11 6360 1 . GLY 12 12 6360 1 . SER 13 13 6360 1 . ALA 14 14 6360 1 . GLN 15 15 6360 1 . VAL 16 16 6360 1 . LYS 17 17 6360 1 . GLY 18 18 6360 1 . HIS 19 19 6360 1 . GLY 20 20 6360 1 . ALA 21 21 6360 1 . LYS 22 22 6360 1 . NH2 23 23 6360 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 6360 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Hb40-61a . . . . . . . . unclassified . . . . . . . . . . . . . . . . . . . . . . . . 6360 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 6360 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Hb40-61a . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6360 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_NH2 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_NH2 _Chem_comp.Entry_ID 6360 _Chem_comp.ID NH2 _Chem_comp.Provenance . _Chem_comp.Name 'AMINO GROUP' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code NH2 _Chem_comp.Ambiguous_flag yes _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2008-10-14 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code NH2 _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 0 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'H2 N' _Chem_comp.Formula_weight 16.023 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code 2FLY _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Mon Aug 1 10:18:50 2011 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1/H3N/h1H3 InChI InChI 1.02b 6360 NH2 N SMILES ACDLabs 10.04 6360 NH2 [NH2] SMILES CACTVS 3.341 6360 NH2 [NH2] SMILES 'OpenEye OEToolkits' 1.5.0 6360 NH2 [NH2] SMILES_CANONICAL CACTVS 3.341 6360 NH2 [NH2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 6360 NH2 QGZKDVFQNNGYKY-UHFFFAOYAF InChIKey InChI 1.02b 6360 NH2 stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID ammonia 'SYSTEMATIC NAME' ACDLabs 10.04 6360 NH2 l^{2}-azane 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 6360 NH2 stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID N . N . . N . . N 0 . . . . no no . . . . 10.091 . 8.978 . -7.810 . 0.000 0.000 0.000 1 . 6360 NH2 HN1 . HN1 . . H . . N 0 . . . . no no . . . . 9.517 . 8.769 . -7.044 . -0.385 -0.545 -0.771 2 . 6360 NH2 HN2 . HN2 . . H . . N 0 . . . . no no . . . . 10.323 . 9.890 . -8.082 . 1.020 0.000 0.000 3 . 6360 NH2 stop_ loop_ _Chem_comp_bond.ID _Chem_comp_bond.Type _Chem_comp_bond.Value_order _Chem_comp_bond.Atom_ID_1 _Chem_comp_bond.Atom_ID_2 _Chem_comp_bond.Aromatic_flag _Chem_comp_bond.Stereo_config _Chem_comp_bond.Ordinal _Chem_comp_bond.Details _Chem_comp_bond.Entry_ID _Chem_comp_bond.Comp_ID 1 . SING N HN1 no N 1 . 6360 NH2 2 . SING N HN2 no N 2 . 6360 NH2 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6360 _Sample.ID 1 _Sample.Type micelles _Sample.Sub_type . _Sample.Details 'SDS micelles' _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'amidated fragment (40-61) of bovine alpha-hemoglobin' . . . 1 $Hb40-61a . . 1.0 . . mM . . . . 6360 1 stop_ save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Ex-cond_1 _Sample_condition_list.Entry_ID 6360 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 4.0 0.1 pH 6360 1 temperature 310 1 K 6360 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRrpipe _Software.Sf_category software _Software.Sf_framecode NMRrpipe _Software.Entry_ID 6360 _Software.ID 1 _Software.Name NMRrpipe _Software.Version 5 _Software.Details ; Delaglio, F.; Grzesiek, S.; Vuister, G. W.; Zhu, G.; Pfeifer, J.; Bax, A. NMRPipe: a multidimensional spectral processing system based on UNIX pipes. J. Biomol. NMR 1995, 6, 277-293. ; save_ save_NMRview _Software.Sf_category software _Software.Sf_framecode NMRview _Software.Entry_ID 6360 _Software.ID 2 _Software.Name NMRView _Software.Version 5 _Software.Details ; Johnson, B.; Blevins, R. A. NMRView: A computer program for the visualization and analysis of NMR data. J. Biomol. NMR 1994, 4, 603-614 ; save_ save_DYANA _Software.Sf_category software _Software.Sf_framecode DYANA _Software.Entry_ID 6360 _Software.ID 3 _Software.Name DYANA _Software.Version 1.5 _Software.Details ; Guntert, P.; Mumenthaler, C.; Wuthrich, K. Torsion angle dynamics for NMR structure calculation with the new program dyana. J. Mol. Biol. 1997, 273, 283-298" ; save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 6360 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 6360 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer Varian Inova . 500 . . . 6360 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 6360 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '1H DQF-COSY' . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6360 1 2 '1H TOCSY' . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6360 1 3 1H-NOESY . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6360 1 4 '1H ROESY' . . . . . . . . . . . 1 $sample_1 . . . 1 $Ex-cond_1 . . . 1 $NMR_spectrometer . . . . . . . . . . . . . . . . 6360 1 stop_ save_ save_NMR_applied_experiment _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_applied_experiment _NMR_spec_expt.Entry_ID 6360 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name . _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $NMR_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 6360 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '1H DQF-COSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $NMR_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 6360 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '1H TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $NMR_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 6360 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name 1H-NOESY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $NMR_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 6360 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name '1H ROESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $NMR_spectrometer _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 6360 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 6360 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_shift_Hb4061a _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_Hb4061a _Assigned_chem_shift_list.Entry_ID 6360 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 6360 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 LYS HA H 1 4.087 0.02 . 1 . . . . . . . . 6360 1 2 . 1 1 1 1 LYS HB3 H 1 1.896 0.02 . 2 . . . . . . . . 6360 1 3 . 1 1 1 1 LYS HG2 H 1 1.360 0.02 . 2 . . . . . . . . 6360 1 4 . 1 1 1 1 LYS HD2 H 1 1.692 0.02 . 2 . . . . . . . . 6360 1 5 . 1 1 2 2 THR H H 1 8.254 0.02 . 1 . . . . . . . . 6360 1 6 . 1 1 2 2 THR HA H 1 4.359 0.02 . 1 . . . . . . . . 6360 1 7 . 1 1 2 2 THR HB H 1 4.007 0.02 . 1 . . . . . . . . 6360 1 8 . 1 1 2 2 THR HG21 H 1 1.081 0.02 . 1 . . . . . . . . 6360 1 9 . 1 1 2 2 THR HG22 H 1 1.081 0.02 . 1 . . . . . . . . 6360 1 10 . 1 1 2 2 THR HG23 H 1 1.081 0.02 . 1 . . . . . . . . 6360 1 11 . 1 1 3 3 TYR H H 1 8.074 0.02 . 1 . . . . . . . . 6360 1 12 . 1 1 3 3 TYR HA H 1 4.368 0.02 . 1 . . . . . . . . 6360 1 13 . 1 1 3 3 TYR HB3 H 1 2.720 0.02 . 2 . . . . . . . . 6360 1 14 . 1 1 3 3 TYR HE2 H 1 7.051 0.02 . 3 . . . . . . . . 6360 1 15 . 1 1 3 3 TYR HD2 H 1 6.753 0.02 . 3 . . . . . . . . 6360 1 16 . 1 1 4 4 PHE H H 1 7.821 0.02 . 1 . . . . . . . . 6360 1 17 . 1 1 4 4 PHE HA H 1 4.862 0.02 . 1 . . . . . . . . 6360 1 18 . 1 1 4 4 PHE HB3 H 1 2.996 0.02 . 2 . . . . . . . . 6360 1 19 . 1 1 4 4 PHE HB2 H 1 3.153 0.02 . 2 . . . . . . . . 6360 1 20 . 1 1 4 4 PHE HE2 H 1 7.246 0.02 . 3 . . . . . . . . 6360 1 21 . 1 1 4 4 PHE HD2 H 1 7.118 0.02 . 3 . . . . . . . . 6360 1 22 . 1 1 5 5 PRO HA H 1 4.266 0.02 . 1 . . . . . . . . 6360 1 23 . 1 1 5 5 PRO HB3 H 1 1.861 0.02 . 2 . . . . . . . . 6360 1 24 . 1 1 5 5 PRO HB2 H 1 2.110 0.02 . 2 . . . . . . . . 6360 1 25 . 1 1 5 5 PRO HG3 H 1 1.783 0.02 . 2 . . . . . . . . 6360 1 26 . 1 1 5 5 PRO HG2 H 1 1.573 0.02 . 2 . . . . . . . . 6360 1 27 . 1 1 5 5 PRO HD3 H 1 3.552 0.02 . 2 . . . . . . . . 6360 1 28 . 1 1 5 5 PRO HD2 H 1 3.487 0.02 . 2 . . . . . . . . 6360 1 29 . 1 1 6 6 HIS H H 1 8.103 0.02 . 1 . . . . . . . . 6360 1 30 . 1 1 6 6 HIS HA H 1 4.643 0.02 . 1 . . . . . . . . 6360 1 31 . 1 1 6 6 HIS HB3 H 1 3.180 0.02 . 2 . . . . . . . . 6360 1 32 . 1 1 6 6 HIS HD2 H 1 8.590 0.02 . 3 . . . . . . . . 6360 1 33 . 1 1 6 6 HIS HE2 H 1 7.232 0.02 . 3 . . . . . . . . 6360 1 34 . 1 1 7 7 PHE H H 1 7.859 0.02 . 1 . . . . . . . . 6360 1 35 . 1 1 7 7 PHE HA H 1 4.637 0.02 . 1 . . . . . . . . 6360 1 36 . 1 1 7 7 PHE HB3 H 1 3.185 0.02 . 2 . . . . . . . . 6360 1 37 . 1 1 7 7 PHE HB2 H 1 2.997 0.02 . 2 . . . . . . . . 6360 1 38 . 1 1 7 7 PHE HZ H 1 7.229 0.02 . 1 . . . . . . . . 6360 1 39 . 1 1 7 7 PHE HE2 H 1 7.293 0.02 . 3 . . . . . . . . 6360 1 40 . 1 1 7 7 PHE HD2 H 1 7.145 0.02 . 3 . . . . . . . . 6360 1 41 . 1 1 8 8 ASP H H 1 8.295 0.02 . 1 . . . . . . . . 6360 1 42 . 1 1 8 8 ASP HA H 1 4.754 0.02 . 1 . . . . . . . . 6360 1 43 . 1 1 8 8 ASP HB3 H 1 2.770 0.02 . 2 . . . . . . . . 6360 1 44 . 1 1 8 8 ASP HB2 H 1 2.951 0.02 . 2 . . . . . . . . 6360 1 45 . 1 1 9 9 LEU H H 1 7.981 0.02 . 1 . . . . . . . . 6360 1 46 . 1 1 9 9 LEU HA H 1 4.313 0.02 . 1 . . . . . . . . 6360 1 47 . 1 1 9 9 LEU HB3 H 1 1.704 0.02 . 2 . . . . . . . . 6360 1 48 . 1 1 9 9 LEU HB2 H 1 1.624 0.02 . 2 . . . . . . . . 6360 1 49 . 1 1 9 9 LEU HD11 H 1 0.950 0.02 . 2 . . . . . . . . 6360 1 50 . 1 1 9 9 LEU HD12 H 1 0.950 0.02 . 2 . . . . . . . . 6360 1 51 . 1 1 9 9 LEU HD13 H 1 0.950 0.02 . 2 . . . . . . . . 6360 1 52 . 1 1 9 9 LEU HD21 H 1 0.897 0.02 . 2 . . . . . . . . 6360 1 53 . 1 1 9 9 LEU HD22 H 1 0.897 0.02 . 2 . . . . . . . . 6360 1 54 . 1 1 9 9 LEU HD23 H 1 0.897 0.02 . 2 . . . . . . . . 6360 1 55 . 1 1 10 10 SER H H 1 8.125 0.02 . 1 . . . . . . . . 6360 1 56 . 1 1 10 10 SER HA H 1 4.404 0.02 . 1 . . . . . . . . 6360 1 57 . 1 1 10 10 SER HB3 H 1 3.858 0.02 . 2 . . . . . . . . 6360 1 58 . 1 1 11 11 HIS H H 1 8.211 0.02 . 1 . . . . . . . . 6360 1 59 . 1 1 11 11 HIS HA H 1 4.724 0.02 . 1 . . . . . . . . 6360 1 60 . 1 1 11 11 HIS HB3 H 1 3.321 0.02 . 2 . . . . . . . . 6360 1 61 . 1 1 11 11 HIS HB2 H 1 3.216 0.02 . 2 . . . . . . . . 6360 1 62 . 1 1 11 11 HIS HD2 H 1 8.696 0.02 . 3 . . . . . . . . 6360 1 63 . 1 1 11 11 HIS HE2 H 1 7.397 0.02 . 3 . . . . . . . . 6360 1 64 . 1 1 12 12 GLY H H 1 8.300 0.02 . 1 . . . . . . . . 6360 1 65 . 1 1 12 12 GLY HA3 H 1 4.007 0.02 . 2 . . . . . . . . 6360 1 66 . 1 1 13 13 SER H H 1 8.147 0.02 . 1 . . . . . . . . 6360 1 67 . 1 1 13 13 SER HA H 1 4.439 0.02 . 1 . . . . . . . . 6360 1 68 . 1 1 13 13 SER HB3 H 1 3.908 0.02 . 2 . . . . . . . . 6360 1 69 . 1 1 14 14 ALA H H 1 8.100 0.02 . 1 . . . . . . . . 6360 1 70 . 1 1 14 14 ALA HA H 1 4.325 0.02 . 1 . . . . . . . . 6360 1 71 . 1 1 14 14 ALA HB1 H 1 1.416 0.02 . 1 . . . . . . . . 6360 1 72 . 1 1 14 14 ALA HB2 H 1 1.416 0.02 . 1 . . . . . . . . 6360 1 73 . 1 1 14 14 ALA HB3 H 1 1.416 0.02 . 1 . . . . . . . . 6360 1 74 . 1 1 15 15 GLN H H 1 8.053 0.02 . 1 . . . . . . . . 6360 1 75 . 1 1 15 15 GLN HA H 1 4.426 0.02 . 1 . . . . . . . . 6360 1 76 . 1 1 15 15 GLN HB3 H 1 2.113 0.02 . 2 . . . . . . . . 6360 1 77 . 1 1 15 15 GLN HB2 H 1 2.020 0.02 . 2 . . . . . . . . 6360 1 78 . 1 1 15 15 GLN HG2 H 1 2.358 0.02 . 2 . . . . . . . . 6360 1 79 . 1 1 15 15 GLN HE21 H 1 6.693 0.02 . 2 . . . . . . . . 6360 1 80 . 1 1 15 15 GLN HE22 H 1 7.379 0.02 . 2 . . . . . . . . 6360 1 81 . 1 1 16 16 VAL H H 1 7.919 0.02 . 1 . . . . . . . . 6360 1 82 . 1 1 16 16 VAL HA H 1 4.019 0.02 . 1 . . . . . . . . 6360 1 83 . 1 1 16 16 VAL HB H 1 2.150 0.02 . 1 . . . . . . . . 6360 1 84 . 1 1 16 16 VAL HG11 H 1 0.965 0.02 . 2 . . . . . . . . 6360 1 85 . 1 1 16 16 VAL HG12 H 1 0.965 0.02 . 2 . . . . . . . . 6360 1 86 . 1 1 16 16 VAL HG13 H 1 0.965 0.02 . 2 . . . . . . . . 6360 1 87 . 1 1 17 17 LYS H H 1 7.992 0.02 . 1 . . . . . . . . 6360 1 88 . 1 1 17 17 LYS HA H 1 4.231 0.02 . 1 . . . . . . . . 6360 1 89 . 1 1 17 17 LYS HB3 H 1 1.872 0.02 . 2 . . . . . . . . 6360 1 90 . 1 1 17 17 LYS HB2 H 1 1.802 0.02 . 2 . . . . . . . . 6360 1 91 . 1 1 17 17 LYS HG2 H 1 1.459 0.02 . 2 . . . . . . . . 6360 1 92 . 1 1 17 17 LYS HD2 H 1 1.708 0.02 . 2 . . . . . . . . 6360 1 93 . 1 1 17 17 LYS HE2 H 1 3.008 0.02 . 2 . . . . . . . . 6360 1 94 . 1 1 17 17 LYS HZ1 H 1 7.259 0.02 . 1 . . . . . . . . 6360 1 95 . 1 1 17 17 LYS HZ2 H 1 7.259 0.02 . 1 . . . . . . . . 6360 1 96 . 1 1 17 17 LYS HZ3 H 1 7.259 0.02 . 1 . . . . . . . . 6360 1 97 . 1 1 18 18 GLY H H 1 8.176 0.02 . 1 . . . . . . . . 6360 1 98 . 1 1 18 18 GLY HA3 H 1 3.860 0.02 . 2 . . . . . . . . 6360 1 99 . 1 1 18 18 GLY HA2 H 1 3.938 0.02 . 2 . . . . . . . . 6360 1 100 . 1 1 19 19 HIS H H 1 8.153 0.02 . 1 . . . . . . . . 6360 1 101 . 1 1 19 19 HIS HA H 1 4.660 0.02 . 1 . . . . . . . . 6360 1 102 . 1 1 19 19 HIS HB3 H 1 3.256 0.02 . 2 . . . . . . . . 6360 1 103 . 1 1 19 19 HIS HB2 H 1 3.340 0.02 . 2 . . . . . . . . 6360 1 104 . 1 1 19 19 HIS HD2 H 1 8.643 0.02 . 3 . . . . . . . . 6360 1 105 . 1 1 19 19 HIS HE2 H 1 7.356 0.02 . 3 . . . . . . . . 6360 1 106 . 1 1 20 20 GLY H H 1 8.300 0.02 . 1 . . . . . . . . 6360 1 107 . 1 1 20 20 GLY HA2 H 1 4.007 0.02 . 2 . . . . . . . . 6360 1 108 . 1 1 21 21 ALA H H 1 8.100 0.02 . 1 . . . . . . . . 6360 1 109 . 1 1 21 21 ALA HA H 1 4.325 0.02 . 1 . . . . . . . . 6360 1 110 . 1 1 21 21 ALA HB1 H 1 1.416 0.02 . 1 . . . . . . . . 6360 1 111 . 1 1 21 21 ALA HB2 H 1 1.416 0.02 . 1 . . . . . . . . 6360 1 112 . 1 1 21 21 ALA HB3 H 1 1.416 0.02 . 1 . . . . . . . . 6360 1 113 . 1 1 22 22 LYS H H 1 8.018 0.02 . 1 . . . . . . . . 6360 1 114 . 1 1 22 22 LYS HA H 1 4.244 0.02 . 1 . . . . . . . . 6360 1 115 . 1 1 22 22 LYS HB3 H 1 1.872 0.02 . 2 . . . . . . . . 6360 1 116 . 1 1 22 22 LYS HB2 H 1 1.802 0.02 . 2 . . . . . . . . 6360 1 117 . 1 1 22 22 LYS HG2 H 1 1.500 0.02 . 2 . . . . . . . . 6360 1 118 . 1 1 22 22 LYS HD2 H 1 1.708 0.02 . 2 . . . . . . . . 6360 1 119 . 1 1 22 22 LYS HE2 H 1 3.019 0.02 . 2 . . . . . . . . 6360 1 120 . 1 1 22 22 LYS HZ1 H 1 7.412 0.02 . 1 . . . . . . . . 6360 1 121 . 1 1 22 22 LYS HZ2 H 1 7.412 0.02 . 1 . . . . . . . . 6360 1 122 . 1 1 22 22 LYS HZ3 H 1 7.412 0.02 . 1 . . . . . . . . 6360 1 123 . 1 1 23 23 NH2 HN1 H 1 7.287 0.02 . 2 . . . . . . . . 6360 1 124 . 1 1 23 23 NH2 HN2 H 1 6.910 0.02 . 2 . . . . . . . . 6360 1 stop_ save_