NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage program type
49122 2jqr 15301 cing 2-parsed STAR comment


data_2jqr_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2jqr 
    _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_2jqr   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2jqr 
    _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   2jqr   "Master copy"    parsed_2jqr   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2jqr 
    _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   2jqr.mr   .   .   "MR format"    1    comment                  "Not applicable"      "Not applicable"    0   parsed_2jqr   1   
        1   2jqr.mr   .   .    XPLOR/CNS     2    distance                 "general distance"     simple             0   parsed_2jqr   1   
        1   2jqr.mr   .   .    XPLOR/CNS     3   "dipolar coupling"        "Not applicable"      "Not applicable"    0   parsed_2jqr   1   
        1   2jqr.mr   .   .   "MR format"    4   "nomenclature mapping"    "Not applicable"      "Not applicable"    0   parsed_2jqr   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_2jqr 
    _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    ELECTRON TRANSPORT                      07-JUN-07   2JQR              
*TITLE     SOLUTION MODEL OF CROSSLINKED COMPLEX OF CYTOCHROME C AND             
*TITLE    2 ADRENODOXIN                                                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CYTOCHROME C ISO-1;                                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES;                                                       
*COMPND   6 MOL_ID: 2;                                                           
*COMPND   7 MOLECULE: ADRENODOXIN, MITOCHONDRIAL;                                
*COMPND   8 CHAIN: B;                                                            
*COMPND   9 FRAGMENT: 2FE-2S FERREDOXIN-TYPE DOMAIN, RESIDUES 62-166;            
*COMPND  10 SYNONYM: ADRENAL FERREDOXIN, FERREDOXIN- 1, HEPATO-                  
*COMPND  11 FERREDOXIN;                                                          
*COMPND  12 ENGINEERED: YES;                                                     
*COMPND  13 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;                       
*SOURCE   3 ORGANISM_COMMON: YEAST;                                              
*SOURCE   4 GENE: CYC1;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PUCCC;                                     
*SOURCE   8 MOL_ID: 2;                                                           
*SOURCE   9 ORGANISM_SCIENTIFIC: BOS TAURUS;                                     
*SOURCE  10 ORGANISM_COMMON: BOVINE;                                             
*SOURCE  11 GENE: FDX1, ADX;                                                     
*SOURCE  12 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE  13 EXPRESSION_SYSTEM_STRAIN: HB101;                                     
*SOURCE  14 EXPRESSION_SYSTEM_VECTOR: PKKHC, PMIXT                               
*KEYWDS    ELECTRON TRANSPORT, CYTOCHROME C, ADRENODOXIN, CROSSLINKED            
*KEYWDS   2 COMPLEX, 2FE2S FERREDOXIN, PSEUDOCONTACT SHIFT,                      
*KEYWDS   3 PARAMAGNETIC RELAXATION ENHANCEMENT, ENCOUNTER COMPLEX               
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    X.XU, W.REINLE, F.HANNEMANN, P.V.KONAREV, D.I.SVERGUN,                
*AUTHOR   2 R.BERNHARDT, M.UBBINK                                                
*REVDAT   1   22-APR-08 2JQR    0                                                

;

save_





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