data_16752 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16752 _Entry.Title ; Mapping the Interacting Regions between Troponins T and C ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-03-03 _Entry.Accession_date 2010-03-03 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _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 Tharin Blumenschein . M.A. . 16752 2 Brian Tripet . P. . 16752 3 Robert Hodges . S. . 16752 4 Brian Sykes . D. . 16752 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID binding_constants 1 16752 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID 'binding constants' 4 16752 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 2 . . 2010-06-03 2010-03-10 update BMRB 'edit assembly name' 16752 1 . . 2010-03-24 2010-03-10 original author 'original release' 16752 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16752 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 11473120 _Citation.Full_citation . _Citation.Title 'Mapping the Interacting Regions between Troponins T and C' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume 276 _Citation.Journal_issue 39 _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 36606 _Citation.Page_last 36612 _Citation.Year 2001 _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 Tharin Blumenschein . M.A. . 16752 1 2 Brian Tripet . P. . 16752 1 3 Robert Hodges . S. . 16752 1 4 Brian Sykes . D. . 16752 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16752 _Assembly.ID 1 _Assembly.Name 'Troponins T and C' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . 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 TnC 1 $TnC A . yes native no no . . . 16752 1 2 TnT(160-193) 2 $TnT(160-193) B . yes native no no . . . 16752 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_TnC _Entity.Sf_category entity _Entity.Sf_framecode TnC _Entity.Entry_ID 16752 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name TnC _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 ; MDDIYKAAVEQLTEEQKNEF KAAFDIFVLGAEDGCISTKE LGKVMRMLGQNPTPEELQEM IDEVDEDGSGTVDFDEFLVM MVRCMKDDSKGKTEEELSDL FRMFDKNADGYIDLEELKIM LQATGETITEDDIEELMKDG DKNNDGRIDYDEFLEFMKGV E ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 161 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not reported' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 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 16190 . cNTnC . . . . . 55.28 89 97.75 97.75 1.95e-52 . . . . 16752 1 2 no BMRB 17103 . cNTnC . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 3 no BMRB 19789 . cNTnC . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 4 no BMRB 25034 . cChimera . . . . . 55.28 141 98.88 98.88 6.14e-54 . . . . 16752 1 5 no BMRB 25035 . cChimeraX . . . . . 55.28 141 98.88 98.88 4.69e-54 . . . . 16752 1 6 no BMRB 25120 . cTnC . . . . . 100.00 161 97.52 98.76 2.41e-104 . . . . 16752 1 7 no BMRB 25495 . cNTnC . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 8 no PDB 1AJ4 . "Structure Of Calcium-Saturated Cardiac Troponin C, Nmr, 1 Structure" . . . . . 98.76 161 98.74 98.74 2.84e-104 . . . . 16752 1 9 no PDB 1AP4 . "Regulatory Domain Of Human Cardiac Troponin C In The Calcium-Saturated State, Nmr, 40 Structures" . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 10 no PDB 1DTL . "Crystal Structure Of Calcium-Saturated (3ca2+) Cardiac Troponin C Complexed With The Calcium Sensitizer Bepridil At 2.15 A Reso" . . . . . 100.00 161 98.14 98.76 4.49e-105 . . . . 16752 1 11 no PDB 1FI5 . "Nmr Structure Of The C Terminal Domain Of Cardiac Troponin C Bound To The N Terminal Domain Of Cardiac Troponin I." . . . . . 50.31 81 100.00 100.00 1.00e-46 . . . . 16752 1 12 no PDB 1J1D . "Crystal Structure Of The 46kda Domain Of Human Cardiac Troponin In The Ca2+ Saturated Form" . . . . . 100.00 161 98.14 98.76 4.49e-105 . . . . 16752 1 13 no PDB 1J1E . "Crystal Structure Of The 52kda Domain Of Human Cardiac Troponin In The Ca2+ Saturated Form" . . . . . 100.00 161 98.14 98.76 4.49e-105 . . . . 16752 1 14 no PDB 1LA0 . "Solution Structure Of Calcium Saturated Cardiac Troponin C In The Troponin C-Troponin I Complex" . . . . . 100.00 161 100.00 100.00 1.48e-107 . . . . 16752 1 15 no PDB 1LXF . "Structure Of The Regulatory N-Domain Of Human Cardiac Troponin C In Complex With Human Cardiac Troponin-I(147- 163) And Bepridi" . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 16 no PDB 1MXL . "Structure Of Cardiac Troponin C-troponin I Complex" . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 17 no PDB 1SBJ . "Nmr Structure Of The Mg2+-Loaded C Terminal Domain Of Cardiac Troponin C Bound To The N Terminal Domain Of Cardiac Troponin I" . . . . . 50.31 81 100.00 100.00 1.00e-46 . . . . 16752 1 18 no PDB 1SCV . "Nmr Structure Of The C Terminal Domain Of Cardiac Troponin C Bound To The N Terminal Domain Of Cardiac Troponin I" . . . . . 50.31 81 100.00 100.00 1.00e-46 . . . . 16752 1 19 no PDB 1SPY . "Regulatory Domain Of Human Cardiac Troponin C In The Calcium-Free State, Nmr, 40 Structures" . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 20 no PDB 1WRK . "Crystal Structure Of The N-Terminal Domain Of Human Cardiac Troponin C In Complex With Trifluoperazine (Orthrombic Crystal Form" . . . . . 54.66 88 97.73 97.73 1.17e-51 . . . . 16752 1 21 no PDB 1WRL . "Crystal Structure Of The N-Terminal Domain Of Human Cardiac Troponin C In Complex With Trifluoperazine (Monoclinic Crystal Form" . . . . . 54.66 88 97.73 97.73 1.17e-51 . . . . 16752 1 22 no PDB 2CTN . "Structure Of Calcium-Saturated Cardiac Troponin C, Nmr, 30 Structures" . . . . . 54.04 89 97.70 97.70 3.73e-51 . . . . 16752 1 23 no PDB 2JXL . "Solution Structure Of Cardiac N-Domain Troponin C Mutant F77w-V82a" . . . . . 55.28 89 97.75 98.88 8.25e-54 . . . . 16752 1 24 no PDB 2KFX . "Structure Of The N-Terminal Domain Of Human Cardiac Troponin C Bound To Calcium Ion And To The Inhibitor W7" . . . . . 55.28 89 97.75 97.75 1.95e-52 . . . . 16752 1 25 no PDB 2KGB . "Nmr Solution Of The Regulatory Domain Cardiac F77w-Troponin C In Complex With The Cardiac Troponin I 144-163 Switch Peptide" . . . . . 55.28 89 98.88 100.00 2.29e-54 . . . . 16752 1 26 no PDB 2KRD . "Solution Structure Of The Regulatory Domain Of Human Cardiac C In Complex With The Switch Region Of Cardiac Troponin I A" . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 27 no PDB 2L1R . "The Structure Of The Calcium-Sensitizer, Dfbp-O, In Complex With The N-Domain Of Troponin C And The Switch Region Of Troponin I" . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 28 no PDB 2MKP . "N Domain Of Cardiac Troponin C Bound To The Switch Fragment Of Fast Skeletal Troponin I At Ph 6" . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 29 no PDB 2MZP . "Structure And Dynamics Of The Acidosis-resistant A162h Mutant Of The Switch Region Of Troponin I Bound To The Regulatory Domain" . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 30 no PDB 3SD6 . "Crystal Structure Of The Amino-terminal Domain Of Human Cardiac Troponin C In Complex With Cadmium At 1.4 Resolution." . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 31 no PDB 3SWB . "Crystal Structure Of The Amino-terminal Domain Of Human Cardiac Troponin C In Complex With Cadmium At 1.7 A Resolution" . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 32 no PDB 4GJE . "Crystal Structure Of The Refolded Amino-terminal Domain Of Human Cardiac Troponin C In Complex With Cadmium" . . . . . 55.28 89 100.00 100.00 1.04e-54 . . . . 16752 1 33 no DBJ BAA02369 . "cardiac troponin C [Gallus gallus]" . . . . . 100.00 161 100.00 100.00 1.48e-107 . . . . 16752 1 34 no DBJ BAG36483 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 161 98.76 100.00 1.36e-106 . . . . 16752 1 35 no EMBL CAA30736 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 161 98.76 100.00 1.36e-106 . . . . 16752 1 36 no EMBL CAG46663 . "TNNC1 [Homo sapiens]" . . . . . 100.00 161 98.76 100.00 1.36e-106 . . . . 16752 1 37 no EMBL CAG46683 . "TNNC1 [Homo sapiens]" . . . . . 100.00 161 98.76 100.00 1.36e-106 . . . . 16752 1 38 no GB AAA36772 . "slow twitch skeletal/cardiac muscle troponin C [Homo sapiens]" . . . . . 100.00 161 98.76 100.00 1.36e-106 . . . . 16752 1 39 no GB AAA37492 . "slow/cardiac troponin C, partial [Mus musculus]" . . . . . 100.00 161 98.14 100.00 4.38e-106 . . . . 16752 1 40 no GB AAA37493 . "slow/cardiac troponin C [Mus musculus]" . . . . . 100.00 161 98.14 100.00 4.38e-106 . . . . 16752 1 41 no GB AAA48654 . "slow muscle troponin C [Gallus gallus]" . . . . . 100.00 161 100.00 100.00 1.48e-107 . . . . 16752 1 42 no GB AAA49502 . "troponin C, partial [Coturnix coturnix]" . . . . . 100.00 160 97.52 99.38 4.30e-104 . . . . 16752 1 43 no PIR S07450 . "troponin C - quail [Phasianidae gen. sp.]" . . . . . 100.00 161 98.14 100.00 2.04e-106 . . . . 16752 1 44 no PIR TPHUCC . "troponin C, cardiac and slow skeletal muscle - human" . . . . . 100.00 161 98.76 100.00 1.36e-106 . . . . 16752 1 45 no PRF 1403394A . "slow/cardiac troponin C [Phasianidae gen. sp.]" . . . . . 100.00 161 98.14 100.00 2.04e-106 . . . . 16752 1 46 no PRF 1510257A . "troponin C" . . . . . 100.00 161 99.38 100.00 3.83e-107 . . . . 16752 1 47 no PRF 750650A . "troponin c,cardiac" . . . . . 100.00 161 99.38 100.00 3.83e-107 . . . . 16752 1 48 no REF NP_001029277 . "troponin C, slow skeletal and cardiac muscles [Rattus norvegicus]" . . . . . 100.00 161 98.14 100.00 4.38e-106 . . . . 16752 1 49 no REF NP_001029523 . "troponin C, slow skeletal and cardiac muscles [Bos taurus]" . . . . . 100.00 161 99.38 100.00 3.83e-107 . . . . 16752 1 50 no REF NP_001123715 . "troponin C, slow skeletal and cardiac muscles [Sus scrofa]" . . . . . 100.00 161 99.38 100.00 3.83e-107 . . . . 16752 1 51 no REF NP_001272501 . "troponin C, slow skeletal and cardiac muscles [Capra hircus]" . . . . . 100.00 161 99.38 100.00 3.83e-107 . . . . 16752 1 52 no REF NP_001291793 . "troponin C type 1 (slow) [Ailuropoda melanoleuca]" . . . . . 100.00 161 97.52 99.38 1.56e-105 . . . . 16752 1 53 no SP P02591 . "RecName: Full=Troponin C, slow skeletal and cardiac muscles; Short=TN-C" . . . . . 100.00 161 98.76 100.00 1.36e-106 . . . . 16752 1 54 no SP P05936 . "RecName: Full=Troponin C, slow skeletal and cardiac muscles; Short=TN-C" . . . . . 100.00 161 98.14 100.00 2.04e-106 . . . . 16752 1 55 no SP P09860 . "RecName: Full=Troponin C, slow skeletal and cardiac muscles; Short=TN-C" . . . . . 100.00 161 100.00 100.00 1.48e-107 . . . . 16752 1 56 no SP P19123 . "RecName: Full=Troponin C, slow skeletal and cardiac muscles; Short=TN-C" . . . . . 100.00 161 98.14 100.00 4.38e-106 . . . . 16752 1 57 no SP P63315 . "RecName: Full=Troponin C, slow skeletal and cardiac muscles; Short=TN-C" . . . . . 100.00 161 99.38 100.00 3.83e-107 . . . . 16752 1 58 no TPG DAA16908 . "TPA: troponin C, slow skeletal and cardiac muscles [Bos taurus]" . . . . . 100.00 161 99.38 100.00 3.83e-107 . . . . 16752 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 . MET . 16752 1 2 . ASP . 16752 1 3 . ASP . 16752 1 4 . ILE . 16752 1 5 . TYR . 16752 1 6 . LYS . 16752 1 7 . ALA . 16752 1 8 . ALA . 16752 1 9 . VAL . 16752 1 10 . GLU . 16752 1 11 . GLN . 16752 1 12 . LEU . 16752 1 13 . THR . 16752 1 14 . GLU . 16752 1 15 . GLU . 16752 1 16 . GLN . 16752 1 17 . LYS . 16752 1 18 . ASN . 16752 1 19 . GLU . 16752 1 20 . PHE . 16752 1 21 . LYS . 16752 1 22 . ALA . 16752 1 23 . ALA . 16752 1 24 . PHE . 16752 1 25 . ASP . 16752 1 26 . ILE . 16752 1 27 . PHE . 16752 1 28 . VAL . 16752 1 29 . LEU . 16752 1 30 . GLY . 16752 1 31 . ALA . 16752 1 32 . GLU . 16752 1 33 . ASP . 16752 1 34 . GLY . 16752 1 35 . CYS . 16752 1 36 . ILE . 16752 1 37 . SER . 16752 1 38 . THR . 16752 1 39 . LYS . 16752 1 40 . GLU . 16752 1 41 . LEU . 16752 1 42 . GLY . 16752 1 43 . LYS . 16752 1 44 . VAL . 16752 1 45 . MET . 16752 1 46 . ARG . 16752 1 47 . MET . 16752 1 48 . LEU . 16752 1 49 . GLY . 16752 1 50 . GLN . 16752 1 51 . ASN . 16752 1 52 . PRO . 16752 1 53 . THR . 16752 1 54 . PRO . 16752 1 55 . GLU . 16752 1 56 . GLU . 16752 1 57 . LEU . 16752 1 58 . GLN . 16752 1 59 . GLU . 16752 1 60 . MET . 16752 1 61 . ILE . 16752 1 62 . ASP . 16752 1 63 . GLU . 16752 1 64 . VAL . 16752 1 65 . ASP . 16752 1 66 . GLU . 16752 1 67 . ASP . 16752 1 68 . GLY . 16752 1 69 . SER . 16752 1 70 . GLY . 16752 1 71 . THR . 16752 1 72 . VAL . 16752 1 73 . ASP . 16752 1 74 . PHE . 16752 1 75 . ASP . 16752 1 76 . GLU . 16752 1 77 . PHE . 16752 1 78 . LEU . 16752 1 79 . VAL . 16752 1 80 . MET . 16752 1 81 . MET . 16752 1 82 . VAL . 16752 1 83 . ARG . 16752 1 84 . CYS . 16752 1 85 . MET . 16752 1 86 . LYS . 16752 1 87 . ASP . 16752 1 88 . ASP . 16752 1 89 . SER . 16752 1 90 . LYS . 16752 1 91 . GLY . 16752 1 92 . LYS . 16752 1 93 . THR . 16752 1 94 . GLU . 16752 1 95 . GLU . 16752 1 96 . GLU . 16752 1 97 . LEU . 16752 1 98 . SER . 16752 1 99 . ASP . 16752 1 100 . LEU . 16752 1 101 . PHE . 16752 1 102 . ARG . 16752 1 103 . MET . 16752 1 104 . PHE . 16752 1 105 . ASP . 16752 1 106 . LYS . 16752 1 107 . ASN . 16752 1 108 . ALA . 16752 1 109 . ASP . 16752 1 110 . GLY . 16752 1 111 . TYR . 16752 1 112 . ILE . 16752 1 113 . ASP . 16752 1 114 . LEU . 16752 1 115 . GLU . 16752 1 116 . GLU . 16752 1 117 . LEU . 16752 1 118 . LYS . 16752 1 119 . ILE . 16752 1 120 . MET . 16752 1 121 . LEU . 16752 1 122 . GLN . 16752 1 123 . ALA . 16752 1 124 . THR . 16752 1 125 . GLY . 16752 1 126 . GLU . 16752 1 127 . THR . 16752 1 128 . ILE . 16752 1 129 . THR . 16752 1 130 . GLU . 16752 1 131 . ASP . 16752 1 132 . ASP . 16752 1 133 . ILE . 16752 1 134 . GLU . 16752 1 135 . GLU . 16752 1 136 . LEU . 16752 1 137 . MET . 16752 1 138 . LYS . 16752 1 139 . ASP . 16752 1 140 . GLY . 16752 1 141 . ASP . 16752 1 142 . LYS . 16752 1 143 . ASN . 16752 1 144 . ASN . 16752 1 145 . ASP . 16752 1 146 . GLY . 16752 1 147 . ARG . 16752 1 148 . ILE . 16752 1 149 . ASP . 16752 1 150 . TYR . 16752 1 151 . ASP . 16752 1 152 . GLU . 16752 1 153 . PHE . 16752 1 154 . LEU . 16752 1 155 . GLU . 16752 1 156 . PHE . 16752 1 157 . MET . 16752 1 158 . LYS . 16752 1 159 . GLY . 16752 1 160 . VAL . 16752 1 161 . GLU . 16752 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 . MET 1 1 16752 1 . ASP 2 2 16752 1 . ASP 3 3 16752 1 . ILE 4 4 16752 1 . TYR 5 5 16752 1 . LYS 6 6 16752 1 . ALA 7 7 16752 1 . ALA 8 8 16752 1 . VAL 9 9 16752 1 . GLU 10 10 16752 1 . GLN 11 11 16752 1 . LEU 12 12 16752 1 . THR 13 13 16752 1 . GLU 14 14 16752 1 . GLU 15 15 16752 1 . GLN 16 16 16752 1 . LYS 17 17 16752 1 . ASN 18 18 16752 1 . GLU 19 19 16752 1 . PHE 20 20 16752 1 . LYS 21 21 16752 1 . ALA 22 22 16752 1 . ALA 23 23 16752 1 . PHE 24 24 16752 1 . ASP 25 25 16752 1 . ILE 26 26 16752 1 . PHE 27 27 16752 1 . VAL 28 28 16752 1 . LEU 29 29 16752 1 . GLY 30 30 16752 1 . ALA 31 31 16752 1 . GLU 32 32 16752 1 . ASP 33 33 16752 1 . GLY 34 34 16752 1 . CYS 35 35 16752 1 . ILE 36 36 16752 1 . SER 37 37 16752 1 . THR 38 38 16752 1 . LYS 39 39 16752 1 . GLU 40 40 16752 1 . LEU 41 41 16752 1 . GLY 42 42 16752 1 . LYS 43 43 16752 1 . VAL 44 44 16752 1 . MET 45 45 16752 1 . ARG 46 46 16752 1 . MET 47 47 16752 1 . LEU 48 48 16752 1 . GLY 49 49 16752 1 . GLN 50 50 16752 1 . ASN 51 51 16752 1 . PRO 52 52 16752 1 . THR 53 53 16752 1 . PRO 54 54 16752 1 . GLU 55 55 16752 1 . GLU 56 56 16752 1 . LEU 57 57 16752 1 . GLN 58 58 16752 1 . GLU 59 59 16752 1 . MET 60 60 16752 1 . ILE 61 61 16752 1 . ASP 62 62 16752 1 . GLU 63 63 16752 1 . VAL 64 64 16752 1 . ASP 65 65 16752 1 . GLU 66 66 16752 1 . ASP 67 67 16752 1 . GLY 68 68 16752 1 . SER 69 69 16752 1 . GLY 70 70 16752 1 . THR 71 71 16752 1 . VAL 72 72 16752 1 . ASP 73 73 16752 1 . PHE 74 74 16752 1 . ASP 75 75 16752 1 . GLU 76 76 16752 1 . PHE 77 77 16752 1 . LEU 78 78 16752 1 . VAL 79 79 16752 1 . MET 80 80 16752 1 . MET 81 81 16752 1 . VAL 82 82 16752 1 . ARG 83 83 16752 1 . CYS 84 84 16752 1 . MET 85 85 16752 1 . LYS 86 86 16752 1 . ASP 87 87 16752 1 . ASP 88 88 16752 1 . SER 89 89 16752 1 . LYS 90 90 16752 1 . GLY 91 91 16752 1 . LYS 92 92 16752 1 . THR 93 93 16752 1 . GLU 94 94 16752 1 . GLU 95 95 16752 1 . GLU 96 96 16752 1 . LEU 97 97 16752 1 . SER 98 98 16752 1 . ASP 99 99 16752 1 . LEU 100 100 16752 1 . PHE 101 101 16752 1 . ARG 102 102 16752 1 . MET 103 103 16752 1 . PHE 104 104 16752 1 . ASP 105 105 16752 1 . LYS 106 106 16752 1 . ASN 107 107 16752 1 . ALA 108 108 16752 1 . ASP 109 109 16752 1 . GLY 110 110 16752 1 . TYR 111 111 16752 1 . ILE 112 112 16752 1 . ASP 113 113 16752 1 . LEU 114 114 16752 1 . GLU 115 115 16752 1 . GLU 116 116 16752 1 . LEU 117 117 16752 1 . LYS 118 118 16752 1 . ILE 119 119 16752 1 . MET 120 120 16752 1 . LEU 121 121 16752 1 . GLN 122 122 16752 1 . ALA 123 123 16752 1 . THR 124 124 16752 1 . GLY 125 125 16752 1 . GLU 126 126 16752 1 . THR 127 127 16752 1 . ILE 128 128 16752 1 . THR 129 129 16752 1 . GLU 130 130 16752 1 . ASP 131 131 16752 1 . ASP 132 132 16752 1 . ILE 133 133 16752 1 . GLU 134 134 16752 1 . GLU 135 135 16752 1 . LEU 136 136 16752 1 . MET 137 137 16752 1 . LYS 138 138 16752 1 . ASP 139 139 16752 1 . GLY 140 140 16752 1 . ASP 141 141 16752 1 . LYS 142 142 16752 1 . ASN 143 143 16752 1 . ASN 144 144 16752 1 . ASP 145 145 16752 1 . GLY 146 146 16752 1 . ARG 147 147 16752 1 . ILE 148 148 16752 1 . ASP 149 149 16752 1 . TYR 150 150 16752 1 . ASP 151 151 16752 1 . GLU 152 152 16752 1 . PHE 153 153 16752 1 . LEU 154 154 16752 1 . GLU 155 155 16752 1 . PHE 156 156 16752 1 . MET 157 157 16752 1 . LYS 158 158 16752 1 . GLY 159 159 16752 1 . VAL 160 160 16752 1 . GLU 161 161 16752 1 stop_ save_ save_TnT(160-193) _Entity.Sf_category entity _Entity.Sf_framecode TnT(160-193) _Entity.Entry_ID 16752 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name TnT(160-193) _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 ; LAKADQKRGKKQTAREMKKK ILAERRKPLNIDHL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 34 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-30 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 DBJ BAB92975 . "troponin T fast skeletal muscle type [Bos taurus]" . . . . . 100.00 271 97.06 100.00 2.55e-12 . . . . 16752 2 2 no DBJ BAB92976 . "troponin T fast skeletal muscle type [Bos taurus]" . . . . . 100.00 271 97.06 100.00 2.52e-12 . . . . 16752 2 3 no DBJ BAB92977 . "troponin T fast skeletal muscle type [Bos taurus]" . . . . . 100.00 266 97.06 100.00 2.49e-12 . . . . 16752 2 4 no DBJ BAB92978 . "troponin T fast skeletal muscle type [Bos taurus]" . . . . . 100.00 266 97.06 100.00 2.52e-12 . . . . 16752 2 5 no DBJ BAB92979 . "troponin T fast skeletal muscle type [Bos taurus]" . . . . . 100.00 260 97.06 100.00 2.63e-12 . . . . 16752 2 6 no EMBL CAE45814 . "hypothetical protein [Homo sapiens]" . . . . . 100.00 256 100.00 100.00 1.53e-12 . . . . 16752 2 7 no EMBL CAG46725 . "TNNT3 [Homo sapiens]" . . . . . 100.00 256 100.00 100.00 1.45e-12 . . . . 16752 2 8 no GB AAA36777 . "troponin T [Homo sapiens]" . . . . . 100.00 258 100.00 100.00 1.17e-12 . . . . 16752 2 9 no GB AAA96440 . "troponin T class IIa beta-4 [Rattus norvegicus]" . . . . . 100.00 243 100.00 100.00 1.23e-12 . . . . 16752 2 10 no GB AAA96441 . "troponin T class Ia alpha-1 [Rattus norvegicus]" . . . . . 100.00 259 100.00 100.00 1.08e-12 . . . . 16752 2 11 no GB AAA96442 . "troponin T class Ib beta-2 [Rattus norvegicus]" . . . . . 100.00 247 100.00 100.00 1.27e-12 . . . . 16752 2 12 no GB AAA96443 . "troponin T class Ic beta-2 [Rattus norvegicus]" . . . . . 100.00 248 100.00 100.00 1.24e-12 . . . . 16752 2 13 no PIR TPRBTS . "troponin T, fast skeletal muscle - rabbit" . . . . . 100.00 266 100.00 100.00 1.45e-12 . . . . 16752 2 14 no PRF 1810398A . troponin:ISOTYPE=T . . . . . 100.00 267 100.00 100.00 1.41e-12 . . . . 16752 2 15 no REF NP_001001441 . "troponin T, fast skeletal muscle [Bos taurus]" . . . . . 100.00 250 97.06 100.00 1.68e-12 . . . . 16752 2 16 no REF NP_001001863 . "troponin T, fast skeletal muscle [Sus scrofa]" . . . . . 100.00 271 97.06 100.00 2.50e-12 . . . . 16752 2 17 no REF NP_001036245 . "troponin T, fast skeletal muscle isoform 3 [Homo sapiens]" . . . . . 100.00 250 100.00 100.00 1.28e-12 . . . . 16752 2 18 no REF NP_001036246 . "troponin T, fast skeletal muscle isoform 2 [Homo sapiens]" . . . . . 100.00 256 100.00 100.00 1.45e-12 . . . . 16752 2 19 no REF NP_001036247 . "troponin T, fast skeletal muscle isoform 4 [Homo sapiens]" . . . . . 100.00 250 100.00 100.00 1.26e-12 . . . . 16752 2 20 no SP P02641 . "RecName: Full=Troponin T, fast skeletal muscle; Short=TnTf; AltName: Full=Fast skeletal muscle troponin T; Short=fTnT [Oryctola" . . . . . 100.00 279 100.00 100.00 1.44e-12 . . . . 16752 2 21 no SP P09739 . "RecName: Full=Troponin T, fast skeletal muscle; Short=TnTf; AltName: Full=Fast skeletal muscle troponin T; Short=fTnT [Rattus n" . . . . . 100.00 259 100.00 100.00 1.07e-12 . . . . 16752 2 22 no SP P45378 . "RecName: Full=Troponin T, fast skeletal muscle; Short=TnTf; AltName: Full=Beta-TnTF; AltName: Full=Fast skeletal muscle troponi" . . . . . 100.00 269 100.00 100.00 1.27e-12 . . . . 16752 2 23 no SP Q75NG9 . "RecName: Full=Troponin T, fast skeletal muscle; Short=TnTf [Sus scrofa]" . . . . . 100.00 271 97.06 100.00 2.50e-12 . . . . 16752 2 24 no SP Q8MKI3 . "RecName: Full=Troponin T, fast skeletal muscle; Short=TnTf [Bos taurus]" . . . . . 100.00 271 97.06 100.00 2.52e-12 . . . . 16752 2 25 no TPG DAA13525 . "TPA: troponin T, fast skeletal muscle [Bos taurus]" . . . . . 100.00 250 97.06 100.00 1.68e-12 . . . . 16752 2 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 . LEU . 16752 2 2 . ALA . 16752 2 3 . LYS . 16752 2 4 . ALA . 16752 2 5 . ASP . 16752 2 6 . GLN . 16752 2 7 . LYS . 16752 2 8 . ARG . 16752 2 9 . GLY . 16752 2 10 . LYS . 16752 2 11 . LYS . 16752 2 12 . GLN . 16752 2 13 . THR . 16752 2 14 . ALA . 16752 2 15 . ARG . 16752 2 16 . GLU . 16752 2 17 . MET . 16752 2 18 . LYS . 16752 2 19 . LYS . 16752 2 20 . LYS . 16752 2 21 . ILE . 16752 2 22 . LEU . 16752 2 23 . ALA . 16752 2 24 . GLU . 16752 2 25 . ARG . 16752 2 26 . ARG . 16752 2 27 . LYS . 16752 2 28 . PRO . 16752 2 29 . LEU . 16752 2 30 . ASN . 16752 2 31 . ILE . 16752 2 32 . ASP . 16752 2 33 . HIS . 16752 2 34 . LEU . 16752 2 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 . LEU 1 1 16752 2 . ALA 2 2 16752 2 . LYS 3 3 16752 2 . ALA 4 4 16752 2 . ASP 5 5 16752 2 . GLN 6 6 16752 2 . LYS 7 7 16752 2 . ARG 8 8 16752 2 . GLY 9 9 16752 2 . LYS 10 10 16752 2 . LYS 11 11 16752 2 . GLN 12 12 16752 2 . THR 13 13 16752 2 . ALA 14 14 16752 2 . ARG 15 15 16752 2 . GLU 16 16 16752 2 . MET 17 17 16752 2 . LYS 18 18 16752 2 . LYS 19 19 16752 2 . LYS 20 20 16752 2 . ILE 21 21 16752 2 . LEU 22 22 16752 2 . ALA 23 23 16752 2 . GLU 24 24 16752 2 . ARG 25 25 16752 2 . ARG 26 26 16752 2 . LYS 27 27 16752 2 . PRO 28 28 16752 2 . LEU 29 29 16752 2 . ASN 30 30 16752 2 . ILE 31 31 16752 2 . ASP 32 32 16752 2 . HIS 33 33 16752 2 . LEU 34 34 16752 2 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 16752 _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 $TnC . 9031 organism . 'Gallus gallus' chicken . . Eukaryota Metazoa Gallus gallus . . . . . . . . . . . . . . . . . . . . . 16752 1 2 2 $TnT(160-193) . 9031 organism . 'Gallus gallus' chicken . . Eukaryota Metazoa Gallus gallus . . . . . . . . . . . . . . . . . . . . . 16752 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 16752 _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 $TnC . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 16752 1 2 2 $TnT(160-193) . 'chemical synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 16752 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16752 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _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 TnC [U-15N] . . 1 $TnC . . 0.6 . . mM . . . . 16752 1 2 TnT(160-193) 'natural abundance' . . 2 $TnT(160-193) . . . 21 62 mM . . . . 16752 1 3 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16752 1 4 imidazole 'natural abundance' . . . . . . 10 . . mM . . . . 16752 1 5 dithiothreitol 'natural abundance' . . . . . . 20 . . mM . . . . 16752 1 6 CaCl2 'natural abundance' . . . . . . 6 . . mM . . . . 16752 1 7 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . 16752 1 8 '2,2-dimethyl-2-silapentane-5-sulfonic acid' 'natural abundance' . . . . . . 0.2 . . mM . . . . 16752 1 9 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16752 1 10 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16752 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 16752 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _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 TnC '[U-13C; U-15N]' . . 1 $TnC . . 0.9 . . mM . . . . 16752 2 2 TnT(160-193) 'natural abundance' . . 2 $TnT(160-193) . . 33 . . mM . . . . 16752 2 3 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16752 2 4 imidazole 'natural abundance' . . . . . . 10 . . mM . . . . 16752 2 5 dithiothreitol 'natural abundance' . . . . . . 20 . . mM . . . . 16752 2 6 CaCl2 'natural abundance' . . . . . . 6 . . mM . . . . 16752 2 7 'sodium azide' 'natural abundance' . . . . . . 0.03 . . % . . . . 16752 2 8 '2,2-dimethyl-2-silapentane-5-sulfonic acid' 'natural abundance' . . . . . . 0.2 . . mM . . . . 16752 2 9 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16752 2 10 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16752 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16752 _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 6.9 . pH 16752 1 pressure 1 . atm 16752 1 temperature 298 . K 16752 1 stop_ save_ ############################ # Computer software used # ############################ save_VNMR _Software.Sf_category software _Software.Sf_framecode VNMR _Software.Entry_ID 16752 _Software.ID 1 _Software.Name VNMR _Software.Version 6.1B _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 16752 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16752 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 16752 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 16752 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16752 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 16752 _Software.ID 3 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 16752 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16752 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 16752 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Unity _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16752 _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 spectrometer_1 Varian Unity . 600 . . . 16752 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 16752 _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 '1D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16752 1 2 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16752 1 3 '1D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16752 1 4 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16752 1 stop_ save_ save_binding_data _Binding_value_list.Sf_category binding_data _Binding_value_list.Sf_framecode binding_data _Binding_value_list.Entry_ID 16752 _Binding_value_list.ID 1 _Binding_value_list.Sample_condition_list_ID 1 _Binding_value_list.Sample_condition_list_label $sample_conditions_1 _Binding_value_list.Details . _Binding_value_list.Text_data_format . _Binding_value_list.Text_data . loop_ _Binding_experiment.Experiment_ID _Binding_experiment.Experiment_name _Binding_experiment.Sample_ID _Binding_experiment.Sample_label _Binding_experiment.Sample_state _Binding_experiment.Entry_ID _Binding_experiment.Binding_value_list_ID 1 '1D 1H-15N HSQC' 1 $sample_1 . 16752 1 2 '2D 1H-15N HSQC' 1 $sample_1 . 16752 1 3 '1D 1H-15N HSQC' 2 $sample_2 . 16752 1 4 '2D 1H-15N HSQC' 2 $sample_2 . 16752 1 stop_ loop_ _Binding_software.Software_ID _Binding_software.Software_label _Binding_software.Method_ID _Binding_software.Method_label _Binding_software.Entry_ID _Binding_software.Binding_value_list_ID 1 $VNMR . . 16752 1 2 $NMRPipe . . 16752 1 3 $NMRView . . 16752 1 stop_ loop_ _Binding_result.ID _Binding_result.Experiment_ID _Binding_result.Assembly_ID _Binding_result.Atm_obs_assembly_atom_ID _Binding_result.Atm_obs_entity_assembly_ID _Binding_result.Atm_obs_entity_ID _Binding_result.Atm_obs_comp_index_ID _Binding_result.Atm_obs_seq_ID _Binding_result.Atm_obs_comp_ID _Binding_result.Atm_obs_atom_ID _Binding_result.Atm_obs_atom_type _Binding_result.Atm_obs_atom_isotope_number _Binding_result.Resonance_ID _Binding_result.Atm_obs_auth_entity_assembly_ID _Binding_result.Atm_obs_auth_seq_ID _Binding_result.Atm_obs_auth_comp_ID _Binding_result.Atm_obs_auth_atom_ID _Binding_result.Expt_observed_param _Binding_result.Val_type _Binding_result.Val _Binding_result.Val_err _Binding_result.Val_units _Binding_result.Entry_ID _Binding_result.Binding_value_list_ID 1 2 1 . 1 1 . . . . . . . . . . . 'chemical shifts' Kd 30.4 6.0 uM 16752 1 2 2 1 . 1 1 . . . . . . . . . . . 'chemical shifts' Kd 38 24 uM 16752 1 3 4 1 . 1 1 . . . . . . . . . . . 'chemical shifts' Kd 30.4 6.0 uM 16752 1 4 4 1 . 1 1 . . . . . . . . . . . 'chemical shifts' Kd 38 24 uM 16752 1 stop_ loop_ _Binding_partners.Binding_result_ID _Binding_partners.Assembly_ID _Binding_partners.Entity_assembly_ID _Binding_partners.Entity_assembly_name _Binding_partners.Entity_ID _Binding_partners.Entity_label _Binding_partners.Entry_ID _Binding_partners.Binding_value_list_ID 1 1 1 TnC 1 $TnC 16752 1 1 1 2 TnT(160-193) 2 $TnT 16752 1 2 1 1 TnC 1 $TnC 16752 1 2 1 2 TnT(160-193) 2 $TnT 16752 1 stop_ save_