NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage program type
29536 1aze cing 2-parsed STAR comment


data_1aze_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1aze 
    _Study_list.ID           1 

    loop_
        _Study.ID 
        _Study.Name 
        _Study.Type 
        _Study.Details 
        _Study.Entry_ID 
        _Study.Study_list_ID 

        1   "Conversion project"    NMR   .   parsed_1aze   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1aze 
    _Entry.Title                       "Original constraint list(s)" 
    _Entry.Version_type                 original 
    _Entry.Submission_date              . 
    _Entry.Accession_date               . 
    _Entry.Last_release_date            . 
    _Entry.Original_release_date        . 
    _Entry.Origination                  . 
    _Entry.NMR_STAR_version             3.1 
    _Entry.Original_NMR_STAR_version    . 
    _Entry.Experimental_method          NMR 
    _Entry.Experimental_method_subtype  . 

    loop_
        _Related_entries.Database_name 
        _Related_entries.Database_accession_code 
        _Related_entries.Relationship 
        _Related_entries.Entry_ID 

        PDB   1aze   "Master copy"    parsed_1aze   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1aze 
    _Constraint_stat_list.ID           1 

    loop_
        _Constraint_file.ID 
        _Constraint_file.Constraint_filename 
        _Constraint_file.Software_ID 
        _Constraint_file.Software_label 
        _Constraint_file.Software_name 
        _Constraint_file.Block_ID 
        _Constraint_file.Constraint_type 
        _Constraint_file.Constraint_subtype 
        _Constraint_file.Constraint_subsubtype 
        _Constraint_file.Constraint_number 
        _Constraint_file.Entry_ID 
        _Constraint_file.Constraint_stat_list_ID 

        1   1aze.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"    0   parsed_1aze   1   
        1   1aze.mr   .   .    DISCOVER      2    stereochemistry           prochirality       "Not applicable"    0   parsed_1aze   1   
        1   1aze.mr   .   .    DISCOVER      3    stereochemistry           chirality          "Not applicable"    0   parsed_1aze   1   
        1   1aze.mr   .   .    DISCOVER      4    distance                 "hydrogen bond"      simple             0   parsed_1aze   1   
        1   1aze.mr   .   .    DISCOVER      5    distance                  NOE                 simple             0   parsed_1aze   1   
        1   1aze.mr   .   .    n/a           6    comment                  "Not applicable"    "Not applicable"    0   parsed_1aze   1   
        1   1aze.mr   .   .    DISCOVER      7   "dihedral angle"          "Not applicable"    "Not applicable"    0   parsed_1aze   1   
        1   1aze.mr   .   .   "MR format"    8   "nomenclature mapping"    "Not applicable"    "Not applicable"    0   parsed_1aze   1   
    stop_

save_


save_MR_file_comment_1
    _Org_constr_file_comment.Sf_category         org_constr_file_comment 
    _Org_constr_file_comment.Entry_ID            parsed_1aze 
    _Org_constr_file_comment.ID                  1 
    _Org_constr_file_comment.Constraint_file_ID  1 
    _Org_constr_file_comment.Block_ID            1 
    _Org_constr_file_comment.Details            "Generated by Wattos" 
    _Org_constr_file_comment.Comment            
;
*HEADER   COMPLEX (ADAPTOR PROTEIN/PEPTIDE)       17-NOV-97   1AZE    
*TITLE    NMR STRUCTURE OF THE COMPLEX BETWEEN THE C32S-Y7V MUTANT OF 
*TITLE   2 THE NSH3 DOMAIN OF GRB2 WITH A PEPTIDE FROM SOS,           
*TITLE   3 10 STRUCTURES                                              
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: GRB2;                                            
*COMPND  3 CHAIN: A;                                                  
*COMPND  4 FRAGMENT: N-TERMINAL SH3 DOMAIN, RESIDUES 1 - 55;          
*COMPND  5 SYNONYM: ASH, GROWTH FACTOR RECEPTOR-BOUND PROTEIN 2;      
*COMPND  6 ENGINEERED: YES;                                           
*COMPND  7 MUTATION: Y7V, C32S;                                       
*COMPND  8 MOL_ID: 2;                                                 
*COMPND  9 MOLECULE: SOS;                                             
*COMPND 10 CHAIN: B;                                                  
*COMPND 11 FRAGMENT: BINDING SITE IN H-SOS, PEPTIDE VPPPVPPRRR;       
*COMPND 12 ENGINEERED: YES                                            
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 SYNTHETIC: SOLID PHASE PEPTIDE SYNTHESIS USING HMP RESIN AS
*SOURCE  3 A CARRIER AND FMOC/T-BU CHEMISTRY;                         
*SOURCE  4 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                         
*SOURCE  5 ORGANISM_COMMON: HUMAN;                                    
*SOURCE  6 MOL_ID: 2;                                                 
*SOURCE  7 SYNTHETIC: SOLID PHASE PEPTIDE SYNTHESIS USING HMP RESIN AS
*SOURCE  8 A CARRIER AND FMOC/T-BU CHEMISTRY;                         
*SOURCE  9 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER;              
*SOURCE 10 ORGANISM_COMMON: FRUIT FLY                                 
*KEYWDS   COMPLEX (ADAPTOR PROTEIN/PEPTIDE), SH3 DOMAIN,              
*KEYWDS  2 GUANINE-NUCLEOTIDE RELEASING FACTOR                        
*EXPDTA   NMR, 10 STRUCTURES                                          
*AUTHOR   M.VIDAL,E.GINCEL,N.GOUDREAU,F.CORNILLE,F.PARKER,            
*AUTHOR  2 M.DUCHESNE,B.TOCQUE,C.GARBAY,B.P.ROQUES                    
*REVDAT  1   18-MAY-99 1AZE    0                                      
 

!BIOSYM restraint 1
!
;

save_





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