data_16759 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16759 _Entry.Title ; Mapping of the anion binding sites on cytochrome c by differential chemical modification of lysine residues ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-03-03 _Entry.Accession_date 2010-03-03 _Entry.Last_release_date 2010-03-24 _Entry.Original_release_date 2010-03-24 _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 Neil Osheroff . . . 16759 2 David Brautigan . L. . 16759 3 E. Margoliash . . . 16759 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID 'binding constants' 1 16759 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID 'binding constants' 2 16759 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 . . 2010-03-24 2010-03-03 original author . 16759 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16759 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 6254024 _Citation.Full_citation . _Citation.Title 'Mapping of anion binding sites on cytochrome c by differential chemical modification of lysine residues' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full . _Citation.Journal_volume 77 _Citation.Journal_issue 8 _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 4439 _Citation.Page_last 4443 _Citation.Year 1980 _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 Neil Osheroff . . . 16759 1 2 David Brautigan . L. . 16759 1 3 E. Margoliash . . . 16759 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16759 _Assembly.ID 1 _Assembly.Name 'cytochrome c/phosphate complex' _Assembly.BMRB_code . _Assembly.Number_of_components . _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 'cytochrome c' 1 $cytochrome_c A . yes native no no . . . 16759 1 2 PO4 2 $PO4 B . yes native no no . . . 16759 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_cytochrome_c _Entity.Sf_category entity _Entity.Sf_framecode cytochrome_c _Entity.Entry_ID 16759 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name cytochrome_c _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 ; GDVEKGKKIFVQKCAQCHTV EKGGKHKTGPNLHGLFGRKT GQAPGFTYTDANKNKGITWK EETLMEYLENPKKYIPGTKM IFAGIKKKTEREDLIAYLKK ATNE ; _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 104 _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 BMRB 1058 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 2 no BMRB 1107 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 3 no BMRB 1108 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 4 no BMRB 1109 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 5 no BMRB 1110 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 6 no BMRB 1111 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 7 no BMRB 1112 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 8 no BMRB 1113 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 9 no BMRB 1114 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 10 no BMRB 1116 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 11 no BMRB 1170 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 12 no BMRB 1171 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 13 no BMRB 1404 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 14 no BMRB 17120 . cytc . . . . . 100.00 105 99.04 100.00 6.87e-68 . . . . 16759 1 15 no BMRB 17340 . cytc . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 16 no BMRB 1736 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 17 no BMRB 1783 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 18 no BMRB 17847 . hCc . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 19 no BMRB 17848 . hCc . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 20 no BMRB 1785 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 21 no BMRB 1787 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 22 no BMRB 1789 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 23 no BMRB 216 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 24 no BMRB 220 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 25 no BMRB 224 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 26 no BMRB 2366 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 27 no BMRB 2367 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 28 no BMRB 2368 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 29 no BMRB 243 . "cytochrome c" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 30 no BMRB 244 . "cytochrome c" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 31 no BMRB 25640 . entity_1 . . . . . 100.00 105 99.04 99.04 8.72e-67 . . . . 16759 1 32 no BMRB 274 . "cytochrome c" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 33 no BMRB 285 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 34 no BMRB 286 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 35 no BMRB 316 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 36 no BMRB 317 . "cytochrome c" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 37 no BMRB 336 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 38 no BMRB 4189 . "cytochrome c" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 39 no BMRB 436 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 40 no BMRB 437 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 41 no BMRB 438 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 42 no BMRB 439 . "cytochrome c" . . . . . 99.04 104 98.06 98.06 9.51e-65 . . . . 16759 1 43 no PDB 1AKK . "Solution Structure Of Oxidized Horse Heart Cytochrome C, Nmr, Minimized Average Structure" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 44 no PDB 1CRC . "Cytochrome C At Low Ionic Strength" . . . . . 100.00 105 100.00 100.00 4.49e-68 . . . . 16759 1 45 no PDB 1FI7 . "Solution Structure Of The Imidazole Complex Of Cytochrome C" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 46 no PDB 1FI9 . "Solution Structure Of The Imidazole Complex Of Cytochrome C" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 47 no PDB 1GIW . "Solution Structure Of Reduced Horse Heart Cytochrome C, Nmr, Minimized Average Structure" . . . . . 99.04 104 100.00 100.00 2.19e-67 . . . . 16759 1 48 no PDB 1HRC . "High-Resolution Three-Dimensional Structure Of Horse Heart Cytochrome C" . . . . . 100.00 105 100.00 100.00 4.49e-68 . . . . 16759 1 49 no PDB 1I5T . "Solution Structure Of Cyanoferricytochrome C" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 50 no PDB 1LC1 . "Solution Structure Of Reduced Horse Heart Cytochrome C In 30% Acetonitrile Solution, Nmr Minimized Average Structure" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 51 no PDB 1LC2 . "Solution Structure Of Reduced Horse Heart Cytochrome C In 30% Acetonitrile Solution, Nmr 30 Structures" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 52 no PDB 1M60 . "Solution Structure Of Zinc-Substituted Cytochrome C" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 53 no PDB 1OCD . "Cytochrome C (Oxidized) From Equus Caballus, Nmr, Minimized Average Structure" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 54 no PDB 1U75 . "Electron Transfer Complex Between Horse Heart Cytochrome C And Zinc- Porphyrin Substituted Cytochrome C Peroxidase" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 55 no PDB 1WEJ . "Igg1 Fab Fragment (Of E8 Antibody) Complexed With Horse Cytochrome C At 1.8 A Resolution" . . . . . 100.00 105 100.00 100.00 4.49e-68 . . . . 16759 1 56 no PDB 2B4Z . "Crystal Structure Of Cytochrome C From Bovine Heart At 1.5 A Resolution." . . . . . 100.00 104 97.12 98.08 8.45e-66 . . . . 16759 1 57 no PDB 2FRC . "Cytochrome C (Reduced) From Equus Caballus, Nmr, Minimized Average Structure" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 58 no PDB 2GIW . "Solution Structure Of Reduced Horse Heart Cytochrome C, Nmr, 40 Structures" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 59 no PDB 2PCB . "Crystal Structure Of A Complex Between Electron Transfer Partners, Cytochrome C Peroxidase And Cytochrome C" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 60 no PDB 2YBB . "Fitted Model For Bovine Mitochondrial Supercomplex I1iii2iv1 By Single Particle Cryo-Em (Emd-1876)" . . . . . 100.00 104 97.12 98.08 8.45e-66 . . . . 16759 1 61 no PDB 3J2T . "An Improved Model Of The Human Apoptosome" . . . . . 100.00 104 97.12 98.08 8.45e-66 . . . . 16759 1 62 no PDB 3NBS . "Crystal Structure Of Dimeric Cytochrome C From Horse Heart" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 63 no PDB 3NBT . "Crystal Structure Of Trimeric Cytochrome C From Horse Heart" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 64 no PDB 3O1Y . "Electron Transfer Complexes: Experimental Mapping Of The Redox- Dependent Cytochrome C Electrostatic Surface" . . . . . 100.00 105 100.00 100.00 4.49e-68 . . . . 16759 1 65 no PDB 3O20 . "Electron Transfer Complexes:experimental Mapping Of The Redox- Dependent Cytochrome C Electrostatic Surface" . . . . . 100.00 105 100.00 100.00 4.49e-68 . . . . 16759 1 66 no PDB 3WC8 . "Dimeric Horse Cytochrome C Obtained By Refolding With Desalting Method" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 67 no PDB 3WUI . "Dimeric Horse Cytochrome C Formed By Refolding From Molten Globule State" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 68 no PDB 4NFG . "K13r Mutant Of Horse Cytochrome C And Yeast Cytochrome C Peroxidase Complex" . . . . . 100.00 104 97.12 100.00 4.02e-66 . . . . 16759 1 69 no PDB 4RSZ . "The X-ray Structure Of The Primary Adduct Formed In The Reaction Between Cisplatin And Cytochrome C" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 70 no GB AAB33495 . "apocytochrome c [horses, heart, Peptide, 104 aa]" . . . . . 100.00 104 98.08 98.08 4.54e-66 . . . . 16759 1 71 no GB AAI05398 . "Cytochrome c, somatic [Bos taurus]" . . . . . 100.00 105 97.12 98.08 6.93e-66 . . . . 16759 1 72 no GB AAX77008 . "cytochrome c-like protein [Sus scrofa]" . . . . . 100.00 105 97.12 98.08 6.93e-66 . . . . 16759 1 73 no GB ABA06541 . "mitochondrial cytochrome c [Bubalus bubalis]" . . . . . 100.00 104 97.12 98.08 8.45e-66 . . . . 16759 1 74 no GB AEB61027 . "cytochrome c-like protein, partial [Equus caballus]" . . . . . 100.00 127 100.00 100.00 1.28e-68 . . . . 16759 1 75 no PRF 610169A . "cytochrome c" . . . . . 100.00 104 100.00 100.00 4.35e-68 . . . . 16759 1 76 no PRF 711086A . "cytochrome c" . . . . . 100.00 104 97.12 100.00 2.47e-67 . . . . 16759 1 77 no REF NP_001039526 . "cytochrome c [Bos taurus]" . . . . . 100.00 105 97.12 98.08 6.93e-66 . . . . 16759 1 78 no REF NP_001123442 . "cytochrome c [Sus scrofa]" . . . . . 100.00 105 97.12 98.08 6.93e-66 . . . . 16759 1 79 no REF NP_001157486 . "cytochrome c [Equus caballus]" . . . . . 100.00 105 99.04 100.00 6.87e-68 . . . . 16759 1 80 no REF XP_004007999 . "PREDICTED: cytochrome c [Ovis aries]" . . . . . 100.00 105 97.12 98.08 6.93e-66 . . . . 16759 1 81 no REF XP_004418964 . "PREDICTED: cytochrome c-like [Ceratotherium simum simum]" . . . . . 100.00 105 98.08 99.04 2.60e-67 . . . . 16759 1 82 no SP P00004 . "RecName: Full=Cytochrome c" . . . . . 100.00 105 100.00 100.00 3.45e-68 . . . . 16759 1 83 no SP P62894 . "RecName: Full=Cytochrome c" . . . . . 100.00 105 97.12 98.08 6.93e-66 . . . . 16759 1 84 no SP P62895 . "RecName: Full=Cytochrome c" . . . . . 100.00 105 97.12 98.08 6.93e-66 . . . . 16759 1 85 no SP P62896 . "RecName: Full=Cytochrome c" . . . . . 100.00 105 97.12 98.08 6.93e-66 . . . . 16759 1 86 no SP P68096 . "RecName: Full=Cytochrome c" . . . . . 100.00 105 99.04 100.00 6.87e-68 . . . . 16759 1 87 no TPG DAA30512 . "TPA: cytochrome c [Bos taurus]" . . . . . 100.00 105 97.12 98.08 6.93e-66 . . . . 16759 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 . GLY . 16759 1 2 . ASP . 16759 1 3 . VAL . 16759 1 4 . GLU . 16759 1 5 . LYS . 16759 1 6 . GLY . 16759 1 7 . LYS . 16759 1 8 . LYS . 16759 1 9 . ILE . 16759 1 10 . PHE . 16759 1 11 . VAL . 16759 1 12 . GLN . 16759 1 13 . LYS . 16759 1 14 . CYS . 16759 1 15 . ALA . 16759 1 16 . GLN . 16759 1 17 . CYS . 16759 1 18 . HIS . 16759 1 19 . THR . 16759 1 20 . VAL . 16759 1 21 . GLU . 16759 1 22 . LYS . 16759 1 23 . GLY . 16759 1 24 . GLY . 16759 1 25 . LYS . 16759 1 26 . HIS . 16759 1 27 . LYS . 16759 1 28 . THR . 16759 1 29 . GLY . 16759 1 30 . PRO . 16759 1 31 . ASN . 16759 1 32 . LEU . 16759 1 33 . HIS . 16759 1 34 . GLY . 16759 1 35 . LEU . 16759 1 36 . PHE . 16759 1 37 . GLY . 16759 1 38 . ARG . 16759 1 39 . LYS . 16759 1 40 . THR . 16759 1 41 . GLY . 16759 1 42 . GLN . 16759 1 43 . ALA . 16759 1 44 . PRO . 16759 1 45 . GLY . 16759 1 46 . PHE . 16759 1 47 . THR . 16759 1 48 . TYR . 16759 1 49 . THR . 16759 1 50 . ASP . 16759 1 51 . ALA . 16759 1 52 . ASN . 16759 1 53 . LYS . 16759 1 54 . ASN . 16759 1 55 . LYS . 16759 1 56 . GLY . 16759 1 57 . ILE . 16759 1 58 . THR . 16759 1 59 . TRP . 16759 1 60 . LYS . 16759 1 61 . GLU . 16759 1 62 . GLU . 16759 1 63 . THR . 16759 1 64 . LEU . 16759 1 65 . MET . 16759 1 66 . GLU . 16759 1 67 . TYR . 16759 1 68 . LEU . 16759 1 69 . GLU . 16759 1 70 . ASN . 16759 1 71 . PRO . 16759 1 72 . LYS . 16759 1 73 . LYS . 16759 1 74 . TYR . 16759 1 75 . ILE . 16759 1 76 . PRO . 16759 1 77 . GLY . 16759 1 78 . THR . 16759 1 79 . LYS . 16759 1 80 . MET . 16759 1 81 . ILE . 16759 1 82 . PHE . 16759 1 83 . ALA . 16759 1 84 . GLY . 16759 1 85 . ILE . 16759 1 86 . LYS . 16759 1 87 . LYS . 16759 1 88 . LYS . 16759 1 89 . THR . 16759 1 90 . GLU . 16759 1 91 . ARG . 16759 1 92 . GLU . 16759 1 93 . ASP . 16759 1 94 . LEU . 16759 1 95 . ILE . 16759 1 96 . ALA . 16759 1 97 . TYR . 16759 1 98 . LEU . 16759 1 99 . LYS . 16759 1 100 . LYS . 16759 1 101 . ALA . 16759 1 102 . THR . 16759 1 103 . ASN . 16759 1 104 . GLU . 16759 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 . GLY 1 1 16759 1 . ASP 2 2 16759 1 . VAL 3 3 16759 1 . GLU 4 4 16759 1 . LYS 5 5 16759 1 . GLY 6 6 16759 1 . LYS 7 7 16759 1 . LYS 8 8 16759 1 . ILE 9 9 16759 1 . PHE 10 10 16759 1 . VAL 11 11 16759 1 . GLN 12 12 16759 1 . LYS 13 13 16759 1 . CYS 14 14 16759 1 . ALA 15 15 16759 1 . GLN 16 16 16759 1 . CYS 17 17 16759 1 . HIS 18 18 16759 1 . THR 19 19 16759 1 . VAL 20 20 16759 1 . GLU 21 21 16759 1 . LYS 22 22 16759 1 . GLY 23 23 16759 1 . GLY 24 24 16759 1 . LYS 25 25 16759 1 . HIS 26 26 16759 1 . LYS 27 27 16759 1 . THR 28 28 16759 1 . GLY 29 29 16759 1 . PRO 30 30 16759 1 . ASN 31 31 16759 1 . LEU 32 32 16759 1 . HIS 33 33 16759 1 . GLY 34 34 16759 1 . LEU 35 35 16759 1 . PHE 36 36 16759 1 . GLY 37 37 16759 1 . ARG 38 38 16759 1 . LYS 39 39 16759 1 . THR 40 40 16759 1 . GLY 41 41 16759 1 . GLN 42 42 16759 1 . ALA 43 43 16759 1 . PRO 44 44 16759 1 . GLY 45 45 16759 1 . PHE 46 46 16759 1 . THR 47 47 16759 1 . TYR 48 48 16759 1 . THR 49 49 16759 1 . ASP 50 50 16759 1 . ALA 51 51 16759 1 . ASN 52 52 16759 1 . LYS 53 53 16759 1 . ASN 54 54 16759 1 . LYS 55 55 16759 1 . GLY 56 56 16759 1 . ILE 57 57 16759 1 . THR 58 58 16759 1 . TRP 59 59 16759 1 . LYS 60 60 16759 1 . GLU 61 61 16759 1 . GLU 62 62 16759 1 . THR 63 63 16759 1 . LEU 64 64 16759 1 . MET 65 65 16759 1 . GLU 66 66 16759 1 . TYR 67 67 16759 1 . LEU 68 68 16759 1 . GLU 69 69 16759 1 . ASN 70 70 16759 1 . PRO 71 71 16759 1 . LYS 72 72 16759 1 . LYS 73 73 16759 1 . TYR 74 74 16759 1 . ILE 75 75 16759 1 . PRO 76 76 16759 1 . GLY 77 77 16759 1 . THR 78 78 16759 1 . LYS 79 79 16759 1 . MET 80 80 16759 1 . ILE 81 81 16759 1 . PHE 82 82 16759 1 . ALA 83 83 16759 1 . GLY 84 84 16759 1 . ILE 85 85 16759 1 . LYS 86 86 16759 1 . LYS 87 87 16759 1 . LYS 88 88 16759 1 . THR 89 89 16759 1 . GLU 90 90 16759 1 . ARG 91 91 16759 1 . GLU 92 92 16759 1 . ASP 93 93 16759 1 . LEU 94 94 16759 1 . ILE 95 95 16759 1 . ALA 96 96 16759 1 . TYR 97 97 16759 1 . LEU 98 98 16759 1 . LYS 99 99 16759 1 . LYS 100 100 16759 1 . ALA 101 101 16759 1 . THR 102 102 16759 1 . ASN 103 103 16759 1 . GLU 104 104 16759 1 stop_ save_ save_PO4 _Entity.Sf_category entity _Entity.Sf_framecode PO4 _Entity.Entry_ID 16759 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name PO4 _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _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 . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID PO4 _Entity.Nonpolymer_comp_label $chem_comp_PO4 _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _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_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 . PO4 . 16759 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 16759 _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 $cytochrome_c . 9796 organism . 'Equus caballus' Horse . . Eukaryota Metazoa Equus caballus . . . . . . . . . . . . . . . . . . . . . 16759 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 16759 _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 $cytochrome_c . 'purified from the natural source' . . . . . . . . . . . . . . . . . . . . . . . . . . 'see sources cited in paper' . . 16759 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_PO4 _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_PO4 _Chem_comp.Entry_ID 16759 _Chem_comp.ID PO4 _Chem_comp.Provenance . _Chem_comp.Name 'PHOSPHATE ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code PO4 _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2011-06-04 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces IPS _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code PO4 _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 -3 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula 'O4 P' _Chem_comp.Formula_weight 94.971 _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 1IXG _Chem_comp.Processing_site EBI _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 Fri Nov 18 14:25:07 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=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-3 InChI InChI 1.03 16759 PO4 NBIIXXVUZAFLBC-UHFFFAOYSA-K InChIKey InChI 1.03 16759 PO4 [O-][P]([O-])([O-])=O SMILES CACTVS 3.341 16759 PO4 [O-][P]([O-])([O-])=O SMILES_CANONICAL CACTVS 3.341 16759 PO4 [O-]P(=O)([O-])[O-] SMILES 'OpenEye OEToolkits' 1.5.0 16759 PO4 [O-]P(=O)([O-])[O-] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 16759 PO4 [O-]P([O-])([O-])=O SMILES ACDLabs 10.04 16759 PO4 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 phosphate 'SYSTEMATIC NAME' ACDLabs 10.04 16759 PO4 phosphate 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 16759 PO4 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 P . P . . P . . N 0 . . . . no no . . . . 29.995 . 23.516 . 13.249 . 0.000 0.000 0.000 1 . 16759 PO4 O1 . O1 . . O . . N 0 . . . . no no . . . . 31.092 . 22.988 . 14.164 . 0.000 -1.288 -0.911 2 . 16759 PO4 O2 . O2 . . O . . N -1 . . . . no no . . . . 30.404 . 24.896 . 12.647 . 0.000 1.288 -0.911 3 . 16759 PO4 O3 . O3 . . O . . N -1 . . . . no no . . . . 29.646 . 22.518 . 12.126 . -1.288 0.000 0.911 4 . 16759 PO4 O4 . O4 . . O . . N -1 . . . . no no . . . . 28.727 . 23.744 . 14.161 . 1.288 0.000 0.911 5 . 16759 PO4 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 . DOUB P O1 no N 1 . 16759 PO4 2 . SING P O2 no N 2 . 16759 PO4 3 . SING P O3 no N 3 . 16759 PO4 4 . SING P O4 no N 4 . 16759 PO4 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16759 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'ferricytochrome C used' _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 PO4 'natural abundance' . . 2 $PO4 . . 8 . . mM . . . . 16759 1 2 'cytochrome c' 'natural abundance' . . 1 $cytochrome_c . . 10 . . mM . . . . 16759 1 3 citrate 'natural abundance' . . . . . . . 2 32 mM . . . . 16759 1 4 EDTA 'natural abundance' . . . . . . 0.2 . . mM . . . . 16759 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16759 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16759 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 16759 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'ferricytochrome c used' _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 PO4 'natural abundance' . . 2 $PO4 . . 8 . . mM . . . . 16759 2 2 'cytochrome c' 'natural abundance' . . 1 $cytochrome_c . . 10 . . mM . . . . 16759 2 3 Cl 'natural abundance' . . . . . . . 2 32 mM . . . . 16759 2 4 EDTA 'natural abundance' . . . . . . 0.2 . . mM . . . . 16759 2 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 16759 2 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 16759 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 16759 _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 7.8 . pH 16759 1 pressure 1 . atm 16759 1 temperature 298 . K 16759 1 stop_ save_ ############################ # Computer software used # ############################ save_software _Software.Sf_category software _Software.Sf_framecode software _Software.Entry_ID 16759 _Software.ID 1 _Software.Name not_given _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'not given' . . 16759 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'not given' 16759 1 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 16759 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details '31P NMR' _NMR_spectrometer.Manufacturer JEOL _NMR_spectrometer.Model FX-90Q _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 90 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 16759 _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 JEOL FX-90Q . 90 '31P NMR' . . 16759 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 16759 _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 '31P NMR' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16759 1 2 '31P NMR' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16759 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 16759 _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 '31P NMR' 1 $sample_1 isotropic 16759 1 2 '31P NMR' 2 $sample_2 isotropic 16759 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 . . . . . . . . . . . 'chemical shifts' Kd 0.0002 . M 16759 1 2 2 1 . 1 1 . . . . . . . . . . . 'chemical shifts' Kd 0.0002 . M 16759 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 'cytochrome c' 1 $cytochrome_c 16759 1 1 1 2 PO4 2 $PO4 16759 1 2 1 1 'cytochrome c' 1 $cytochrome_c 16759 1 2 1 2 PO4 2 $PO4 16759 1 stop_ save_