NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id cing stage program type
29494 1axl cing 2-parsed STAR comment 

data_1axl_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1axl 
    _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_1axl   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1axl 
    _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   1axl   "Master copy"    parsed_1axl   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1axl 
    _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   1axl.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"    0   parsed_1axl   1   
        1   1axl.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             0   parsed_1axl   1   
        1   1axl.mr   .   .    n/a           3    comment                  "Not applicable"    "Not applicable"    0   parsed_1axl   1   
        1   1axl.mr   .   .   "MR format"    4   "nomenclature mapping"    "Not applicable"    "Not applicable"    0   parsed_1axl   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_1axl 
    _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   DEOXYRIBONUCLEIC ACID                   16-OCT-97   1AXL    
*TITLE    SOLUTION CONFORMATION OF THE (-)-TRANS-ANTI-[BP]DG ADDUCT   
*TITLE   2 OPPOSITE A DELETION SITE IN DNA DUPLEX                     
*TITLE   3 D(CCATC-[BP]G-CTACC)D(GGTAG--GATGG), NMR, 6 STRUCTURES     
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: DNA DUPLEX D(CCATC-[BP]G-CTACC)D(GGTAG--GATGG);  
*COMPND  3 CHAIN: A, B;                                               
*COMPND  4 ENGINEERED: YES;                                           
*COMPND  5 OTHER_DETAILS: D(C1-C2-A3-T4-C5-[BP]G6-C7-T8-A9-C10-C11) D 
*COMPND  6 (G11-G12-T13-A14-G15--G16-A17-T18-G19-G20) WITH CC10 ATOM  
*COMPND  7 OF BP LINKED TO N2 ATOM OF DG6                             
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 SYNTHETIC: YES                                             
*KEYWDS   DEOXYRIBONUCLEIC ACID, DNA, BENZO[A]PYRENE, CARCINOGEN      
*EXPDTA   NMR, 6 STRUCTURES                                           
*AUTHOR   B.FENG,A.A.GORIN,A.KOLBANOVSKIY,B.E.HINGERTY,               
*AUTHOR  2 N.E.GEACINTOV,S.BROYDE,D.J.PATEL                           
*REVDAT  1   01-JUL-98 1AXL    0                                      
 
set echo=false end
;

save_

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