data_17187 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17187 _Entry.Title ; Elucidation of the poly-L-proline binding site in Acanthamoeba profilin I by NMR spectroscopy ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-09-10 _Entry.Accession_date 2010-09-10 _Entry.Last_release_date 2010-11-10 _Entry.Original_release_date 2010-11-10 _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 Sharon Archer . J. . 17187 2 Valda Vinson . K. . 17187 3 Thomas Pollard . D. . 17187 4 Dennis Torchia . A. . 17187 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID 'binding constants' 1 17187 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID 'binding constants' 8 17187 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 1 . . 2010-11-10 2010-09-10 original author . 17187 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17187 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 8287969 _Citation.Full_citation . _Citation.Title 'Elucidation of the poly-L-proline binding site in Acanthamoeba profilin I by NMR spectroscopy' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'FEBS Lett.' _Citation.Journal_name_full 'FEBS Letters' _Citation.Journal_volume 337 _Citation.Journal_issue . _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 145 _Citation.Page_last 151 _Citation.Year 1994 _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 Sharon Archer . J. . 17187 1 2 Valda Vinson . K. . 17187 1 3 Thomas Pollard . D. . 17187 1 4 Dennis Torchia . A. . 17187 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17187 _Assembly.ID 1 _Assembly.Name 'profilinI/pLp complex' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _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 profilinI 1 $profilinI A . yes native no no . . . 17187 1 2 pLp 2 $pLp B . yes native no no . . . 17187 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_profilinI _Entity.Sf_category entity _Entity.Sf_framecode profilinI _Entity.Entry_ID 17187 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name profilinI _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 ; MSWQTYVDTNLVGTGAVTQA AILGLDGNTWATSAGFAVTP AQGQTLASAFNNADPIRASG FDLAGVHYVTLRADDRSIYG KKGSAGVITVKTSKSILVGV YNEKIQPGTAANVVEKLADY LIGQGF ; _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 126 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not reported' _Entity.Src_method . _Entity.Parent_entity_ID 1 _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 PDB 1PRQ . "Acanthamoeba Castellanii Profilin Ia" . . . . . 99.21 125 100.00 100.00 1.69e-82 . . . . 17187 1 2 no PDB 2PRF . "Three Dimensional Solution Structure Of Acanthamoeba Profilin I" . . . . . 99.21 125 100.00 100.00 1.69e-82 . . . . 17187 1 3 no GB AAA27710 . "profilin I [Acanthamoeba castellanii]" . . . . . 100.00 126 100.00 100.00 1.65e-83 . . . . 17187 1 4 no GB ELR22869 . "profilin, putative [Acanthamoeba castellanii str. Neff]" . . . . . 100.00 126 100.00 100.00 1.65e-83 . . . . 17187 1 5 no REF XP_004351646 . "profilin, putative [Acanthamoeba castellanii str. Neff]" . . . . . 100.00 126 100.00 100.00 1.65e-83 . . . . 17187 1 6 no SP P68696 . "RecName: Full=Profilin-1A; AltName: Full=Acidic profilin IA; AltName: Full=Profilin IA" . . . . . 100.00 126 100.00 100.00 1.65e-83 . . . . 17187 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 . 17187 1 2 . SER . 17187 1 3 . TRP . 17187 1 4 . GLN . 17187 1 5 . THR . 17187 1 6 . TYR . 17187 1 7 . VAL . 17187 1 8 . ASP . 17187 1 9 . THR . 17187 1 10 . ASN . 17187 1 11 . LEU . 17187 1 12 . VAL . 17187 1 13 . GLY . 17187 1 14 . THR . 17187 1 15 . GLY . 17187 1 16 . ALA . 17187 1 17 . VAL . 17187 1 18 . THR . 17187 1 19 . GLN . 17187 1 20 . ALA . 17187 1 21 . ALA . 17187 1 22 . ILE . 17187 1 23 . LEU . 17187 1 24 . GLY . 17187 1 25 . LEU . 17187 1 26 . ASP . 17187 1 27 . GLY . 17187 1 28 . ASN . 17187 1 29 . THR . 17187 1 30 . TRP . 17187 1 31 . ALA . 17187 1 32 . THR . 17187 1 33 . SER . 17187 1 34 . ALA . 17187 1 35 . GLY . 17187 1 36 . PHE . 17187 1 37 . ALA . 17187 1 38 . VAL . 17187 1 39 . THR . 17187 1 40 . PRO . 17187 1 41 . ALA . 17187 1 42 . GLN . 17187 1 43 . GLY . 17187 1 44 . GLN . 17187 1 45 . THR . 17187 1 46 . LEU . 17187 1 47 . ALA . 17187 1 48 . SER . 17187 1 49 . ALA . 17187 1 50 . PHE . 17187 1 51 . ASN . 17187 1 52 . ASN . 17187 1 53 . ALA . 17187 1 54 . ASP . 17187 1 55 . PRO . 17187 1 56 . ILE . 17187 1 57 . ARG . 17187 1 58 . ALA . 17187 1 59 . SER . 17187 1 60 . GLY . 17187 1 61 . PHE . 17187 1 62 . ASP . 17187 1 63 . LEU . 17187 1 64 . ALA . 17187 1 65 . GLY . 17187 1 66 . VAL . 17187 1 67 . HIS . 17187 1 68 . TYR . 17187 1 69 . VAL . 17187 1 70 . THR . 17187 1 71 . LEU . 17187 1 72 . ARG . 17187 1 73 . ALA . 17187 1 74 . ASP . 17187 1 75 . ASP . 17187 1 76 . ARG . 17187 1 77 . SER . 17187 1 78 . ILE . 17187 1 79 . TYR . 17187 1 80 . GLY . 17187 1 81 . LYS . 17187 1 82 . LYS . 17187 1 83 . GLY . 17187 1 84 . SER . 17187 1 85 . ALA . 17187 1 86 . GLY . 17187 1 87 . VAL . 17187 1 88 . ILE . 17187 1 89 . THR . 17187 1 90 . VAL . 17187 1 91 . LYS . 17187 1 92 . THR . 17187 1 93 . SER . 17187 1 94 . LYS . 17187 1 95 . SER . 17187 1 96 . ILE . 17187 1 97 . LEU . 17187 1 98 . VAL . 17187 1 99 . GLY . 17187 1 100 . VAL . 17187 1 101 . TYR . 17187 1 102 . ASN . 17187 1 103 . GLU . 17187 1 104 . LYS . 17187 1 105 . ILE . 17187 1 106 . GLN . 17187 1 107 . PRO . 17187 1 108 . GLY . 17187 1 109 . THR . 17187 1 110 . ALA . 17187 1 111 . ALA . 17187 1 112 . ASN . 17187 1 113 . VAL . 17187 1 114 . VAL . 17187 1 115 . GLU . 17187 1 116 . LYS . 17187 1 117 . LEU . 17187 1 118 . ALA . 17187 1 119 . ASP . 17187 1 120 . TYR . 17187 1 121 . LEU . 17187 1 122 . ILE . 17187 1 123 . GLY . 17187 1 124 . GLN . 17187 1 125 . GLY . 17187 1 126 . PHE . 17187 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 17187 1 . SER 2 2 17187 1 . TRP 3 3 17187 1 . GLN 4 4 17187 1 . THR 5 5 17187 1 . TYR 6 6 17187 1 . VAL 7 7 17187 1 . ASP 8 8 17187 1 . THR 9 9 17187 1 . ASN 10 10 17187 1 . LEU 11 11 17187 1 . VAL 12 12 17187 1 . GLY 13 13 17187 1 . THR 14 14 17187 1 . GLY 15 15 17187 1 . ALA 16 16 17187 1 . VAL 17 17 17187 1 . THR 18 18 17187 1 . GLN 19 19 17187 1 . ALA 20 20 17187 1 . ALA 21 21 17187 1 . ILE 22 22 17187 1 . LEU 23 23 17187 1 . GLY 24 24 17187 1 . LEU 25 25 17187 1 . ASP 26 26 17187 1 . GLY 27 27 17187 1 . ASN 28 28 17187 1 . THR 29 29 17187 1 . TRP 30 30 17187 1 . ALA 31 31 17187 1 . THR 32 32 17187 1 . SER 33 33 17187 1 . ALA 34 34 17187 1 . GLY 35 35 17187 1 . PHE 36 36 17187 1 . ALA 37 37 17187 1 . VAL 38 38 17187 1 . THR 39 39 17187 1 . PRO 40 40 17187 1 . ALA 41 41 17187 1 . GLN 42 42 17187 1 . GLY 43 43 17187 1 . GLN 44 44 17187 1 . THR 45 45 17187 1 . LEU 46 46 17187 1 . ALA 47 47 17187 1 . SER 48 48 17187 1 . ALA 49 49 17187 1 . PHE 50 50 17187 1 . ASN 51 51 17187 1 . ASN 52 52 17187 1 . ALA 53 53 17187 1 . ASP 54 54 17187 1 . PRO 55 55 17187 1 . ILE 56 56 17187 1 . ARG 57 57 17187 1 . ALA 58 58 17187 1 . SER 59 59 17187 1 . GLY 60 60 17187 1 . PHE 61 61 17187 1 . ASP 62 62 17187 1 . LEU 63 63 17187 1 . ALA 64 64 17187 1 . GLY 65 65 17187 1 . VAL 66 66 17187 1 . HIS 67 67 17187 1 . TYR 68 68 17187 1 . VAL 69 69 17187 1 . THR 70 70 17187 1 . LEU 71 71 17187 1 . ARG 72 72 17187 1 . ALA 73 73 17187 1 . ASP 74 74 17187 1 . ASP 75 75 17187 1 . ARG 76 76 17187 1 . SER 77 77 17187 1 . ILE 78 78 17187 1 . TYR 79 79 17187 1 . GLY 80 80 17187 1 . LYS 81 81 17187 1 . LYS 82 82 17187 1 . GLY 83 83 17187 1 . SER 84 84 17187 1 . ALA 85 85 17187 1 . GLY 86 86 17187 1 . VAL 87 87 17187 1 . ILE 88 88 17187 1 . THR 89 89 17187 1 . VAL 90 90 17187 1 . LYS 91 91 17187 1 . THR 92 92 17187 1 . SER 93 93 17187 1 . LYS 94 94 17187 1 . SER 95 95 17187 1 . ILE 96 96 17187 1 . LEU 97 97 17187 1 . VAL 98 98 17187 1 . GLY 99 99 17187 1 . VAL 100 100 17187 1 . TYR 101 101 17187 1 . ASN 102 102 17187 1 . GLU 103 103 17187 1 . LYS 104 104 17187 1 . ILE 105 105 17187 1 . GLN 106 106 17187 1 . PRO 107 107 17187 1 . GLY 108 108 17187 1 . THR 109 109 17187 1 . ALA 110 110 17187 1 . ALA 111 111 17187 1 . ASN 112 112 17187 1 . VAL 113 113 17187 1 . VAL 114 114 17187 1 . GLU 115 115 17187 1 . LYS 116 116 17187 1 . LEU 117 117 17187 1 . ALA 118 118 17187 1 . ASP 119 119 17187 1 . TYR 120 120 17187 1 . LEU 121 121 17187 1 . ILE 122 122 17187 1 . GLY 123 123 17187 1 . GLN 124 124 17187 1 . GLY 125 125 17187 1 . PHE 126 126 17187 1 stop_ save_ save_pLp _Entity.Sf_category entity _Entity.Sf_framecode pLp _Entity.Entry_ID 17187 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name pLp _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 PPPPPPPPPP _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 10 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 2 _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 . 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 . . PDB 1AWI . . . . . . . . . . . . . . . . 17187 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 . PRO . 17187 2 2 . PRO . 17187 2 3 . PRO . 17187 2 4 . PRO . 17187 2 5 . PRO . 17187 2 6 . PRO . 17187 2 7 . PRO . 17187 2 8 . PRO . 17187 2 9 . PRO . 17187 2 10 . PRO . 17187 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 . PRO 1 1 17187 2 . PRO 2 2 17187 2 . PRO 3 3 17187 2 . PRO 4 4 17187 2 . PRO 5 5 17187 2 . PRO 6 6 17187 2 . PRO 7 7 17187 2 . PRO 8 8 17187 2 . PRO 9 9 17187 2 . PRO 10 10 17187 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 17187 _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 $profilinI . 5755 organism . 'Acanthamoeba castellanii' 'Acanthamoeba castellanii' . . Eukaryota . Acanthamoeba castellanii . . . . . . . . . . . . . . . . . . . . . 17187 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 17187 _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 $profilinI . 'purified from the natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 17187 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17187 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'profilinI was titrated with aliquots of a concentrated solution of pLp which also contained 0.1 mM profilinI so that the concentration of profilinI remained constant' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 profilinI '[U-13C; U-15N]' . . 1 $profilinI . . 0.1 . . mM . . . . 17187 1 2 pLp 'natural abundance' . . 2 $pLp . . . 0 8 mM . . . . 17187 1 3 H2O 'natural abundance' . . . . . . 93 . . % . . . . 17187 1 4 D2O 'natural abundance' . . . . . . 7 . . % . . . . 17187 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 17187 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'profilinI was titrated with aliquots of a concentrated solution of pLp which also contained 0.1 mM profilinI so that the concentration of profilinI remained constant' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 profilinI '[U-13C; U-15N]' . . 1 $profilinI . . 1.0 . . mM . . . . 17187 2 2 pLp 'natural abundance' . . 2 $pLp . . 0-8 0 8 mM . . . . 17187 2 3 H2O 'natural abundance' . . . . . . 93 . . % . . . . 17187 2 4 D2O 'natural abundance' . . . . . . 7 . . % . . . . 17187 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 17187 _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 6.4 . pH 17187 1 pressure ambient . atm 17187 1 temperature 303 . K 17187 1 stop_ save_ ############################ # Computer software used # ############################ save_inhouse _Software.Sf_category software _Software.Sf_framecode inhouse _Software.Entry_ID 17187 _Software.ID 1 _Software.Name inhouse _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'F. Delaglio, nmrpipe , unpublished)' . . 17187 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17187 1 stop_ save_ save_NMRi _Software.Sf_category software _Software.Sf_framecode NMRi _Software.Entry_ID 17187 _Software.ID 2 _Software.Name NMRi _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID '(New Methods Research Inc., Syracuse, NY' . . 17187 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17187 2 stop_ save_ save_inhouse2 _Software.Sf_category software _Software.Sf_framecode inhouse2 _Software.Entry_ID 17187 _Software.ID 3 _Software.Name inhouse2 _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Garrett, D.S., Powers, R., Gronenborn, A.M. and Clore, G.M.' . . 17187 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17187 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 17187 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 17187 _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 Bruker AMX . 500 . . . 17187 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 17187 _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 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17187 1 2 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17187 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 17187 _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 '2D 1H-15N HSQC' 1 $sample_1 isotropic 17187 1 2 '2D 1H-15N HSQC' 2 $sample_2 isotropic 17187 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 $inhouse . . 17187 1 2 $NMRi . . 17187 1 3 $inhouse2 . . 17187 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 1 1 . 1 1 2 2 TRP . . . . . . . . 'chemical shifts' Kd 410 . uM 17187 1 2 1 1 . 1 1 9 9 ASN . . . . . . . . 'chemical shifts' Kd 370 . uM 17187 1 3 1 1 . 1 1 123 123 GLN . . . . . . . . 'chemical shifts' Kd 370 . uM 17187 1 4 1 1 . 1 1 . . . . . . . . . . . 'chemical shifts' Kd 40000000 . s-1M-1 17187 1 5 1 1 . 1 1 . . . . . . . . . . . 'chemical shifts' Kdmin 0.42 . mM 17187 1 6 1 1 . 1 1 . . . . . . . . . . . 'chemical shifts' Kdmax 0.46 . mM 17187 1 7 1 1 . 1 1 . . . . . . . . . . . 'chemical shifts' Kdeq 0.4 . mM 17187 1 8 2 1 . 1 1 . . . . . . . . . . . 'chemical shifts' Kd 1.2 . mM 17187 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 profilinI 1 $profilinI 17187 1 1 1 2 pLp 2 $pLp 17187 1 2 1 1 profilinI 1 $profilinI 17187 1 2 1 2 pLp 2 $pLp 17187 1 3 1 1 profilinI 1 $profilinI 17187 1 3 1 2 pLp 2 $pLp 17187 1 4 1 1 profilinI 1 $profilinI 17187 1 4 1 2 pLp 2 $pLp 17187 1 5 1 1 profilinI 1 $profilinI 17187 1 5 1 2 pLp 2 $pLp 17187 1 6 1 1 profilinI 1 $profilinI 17187 1 6 1 2 pLp 2 $pLp 17187 1 7 1 1 profilinI 1 $profilinI 17187 1 7 1 2 pLp 2 $pLp 17187 1 8 1 1 profilinI 1 $profilinI 17187 1 8 1 2 pLp 2 $pLp 17187 1 stop_ save_