NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type
29250 1aoo cing 2-parsed STAR comment


data_1aoo_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1aoo 
    _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_1aoo   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1aoo 
    _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   1aoo   "Master copy"    parsed_1aoo   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1aoo 
    _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   1aoo.mr   .   .   "MR format"    1    comment                  "Not applicable"      "Not applicable"    0   parsed_1aoo   1   
        1   1aoo.mr   .   .    XPLOR/CNS     2    distance                 "general distance"     simple             0   parsed_1aoo   1   
        1   1aoo.mr   .   .    n/a           3    comment                  "Not applicable"      "Not applicable"    0   parsed_1aoo   1   
        1   1aoo.mr   .   .    XPLOR/CNS     4    distance                 "general distance"     simple             0   parsed_1aoo   1   
        1   1aoo.mr   .   .    n/a           5    comment                  "Not applicable"      "Not applicable"    0   parsed_1aoo   1   
        1   1aoo.mr   .   .    XPLOR/CNS     6    distance                 "general distance"     simple             0   parsed_1aoo   1   
        1   1aoo.mr   .   .    XPLOR/CNS     7    distance                  NOE                   simple             0   parsed_1aoo   1   
        1   1aoo.mr   .   .    n/a           8    comment                  "Not applicable"      "Not applicable"    0   parsed_1aoo   1   
        1   1aoo.mr   .   .   "MR format"    9   "nomenclature mapping"    "Not applicable"      "Not applicable"    0   parsed_1aoo   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_1aoo 
    _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   METALLOTHIONEIN                         08-JUL-97   1AOO    
*TITLE    AG-SUBSTITUTED METALLOTHIONEIN FROM SACCHAROMYCES           
*TITLE   2 CEREVISIAE, NMR, MINIMIZED AVERAGE STRUCTURE               
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: AG-METALLOTHIONEIN;                              
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 SYNONYM: AG-MT;                                            
*COMPND  5 BIOLOGICAL_UNIT: MONOMER;                                  
*COMPND  6 OTHER_DETAILS: AG(I) SUBSTITUTED                           
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;             
*SOURCE  3 ORGANISM_COMMON: BAKER'S YEAST;                            
*SOURCE  4 STRAIN: 301N                                               
*KEYWDS   METALLOTHIONEIN, COPPER DETOXIFICATION, METAL-THIOLATE      
*KEYWDS  2 CLUSTER                                                    
*EXPDTA   NMR, MINIMIZED AVERAGE STRUCTURE                            
*AUTHOR   C.W.PETERSON,S.S.NARULA,I.M.ARMITAGE                        
*REVDAT  1   24-DEC-97 1AOO    0                                      
 
!NOE data for Ag-MT
remarks this is a hybrid of noeSN.tbl and my AG-AG,SG-SG,AG-SG noe's
remarks The distance calibration is according to Gronenborn Paper.
set message=off echo=off end
!
class     1a
;

save_





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