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 subtype subsubtype
584860 2mv6 25079 cing 2-parsed STAR distance hydrogen bond simple


data_2mv6_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2mv6 
    _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_2mv6   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2mv6 
    _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   2mv6   "Master copy"    parsed_2mv6   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2mv6 
    _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   2mv6.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"     0   parsed_2mv6   1   
        1   2mv6.mr   .   .    XPLOR/CNS     2   "dihedral angle"          "Not applicable"    "Not applicable"    80   parsed_2mv6   1   
        1   2mv6.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple              0   parsed_2mv6   1   
        1   2mv6.mr   .   .    XPLOR/CNS     4    distance                  NOE                 simple              0   parsed_2mv6   1   
        1   2mv6.mr   .   .   "MR format"    5   "nomenclature mapping"    "Not applicable"    "Not applicable"     0   parsed_2mv6   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_3
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2mv6 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type    "hydrogen bond" 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            3 
    _Distance_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Dist_constraint_parse_err.ID 
        _Dist_constraint_parse_err.Content 
        _Dist_constraint_parse_err.Begin_line 
        _Dist_constraint_parse_err.Begin_column 
        _Dist_constraint_parse_err.End_line 
        _Dist_constraint_parse_err.End_column 
        _Dist_constraint_parse_err.Entry_ID 
        _Dist_constraint_parse_err.Distance_constraint_list_ID 

         1   "assign ( residue   35 and name n  )( residue   35  and name hn ) ( residue   31  and name O )"     1   1    1   93   parsed_2mv6   1   
         2   "assign ( residue   33 and name n  )( residue   33  and name hn ) ( residue   29  and name O )"     2   1    2   93   parsed_2mv6   1   
         3   "assign ( residue   22 and name n  )( residue   22  and name hn ) ( residue   18  and name O )"     3   1    3   93   parsed_2mv6   1   
         4   "assign ( residue   38 and name n  )( residue   38  and name hn ) ( residue   34  and name O )"     4   1    4   93   parsed_2mv6   1   
         5   "assign ( residue   21 and name n  )( residue   21  and name hn ) ( residue   17  and name O )"     5   1    5   93   parsed_2mv6   1   
         6   "assign ( residue   19 and name n  )( residue   19  and name hn ) ( residue   15  and name O )"     6   1    6   93   parsed_2mv6   1   
         7   "assign ( residue   32 and name n  )( residue   32  and name hn ) ( residue   28  and name O )"     7   1    7   93   parsed_2mv6   1   
         8   "assign ( residue   23 and name n  )( residue   23  and name hn ) ( residue   19  and name O )"     8   1    8   93   parsed_2mv6   1   
         9   "assign ( residue   43 and name n  )( residue   43  and name hn ) ( residue   39  and name O )"     9   1    9   93   parsed_2mv6   1   
        10   "assign ( residue   25 and name n  )( residue   25  and name hn ) ( residue   21  and name O )"    10   1   10   93   parsed_2mv6   1   
        11   "assign ( residue   24 and name n  )( residue   24  and name hn ) ( residue   20  and name O )"    11   1   11   93   parsed_2mv6   1   
        12   "assign ( residue   17 and name n  )( residue   17  and name hn ) ( residue   13  and name O )"    12   1   12   93   parsed_2mv6   1   
        13   "assign ( residue   24 and name n  )( residue   24  and name hn ) ( residue   20  and name O )"    13   1   13   93   parsed_2mv6   1   
        14   "assign ( residue   27 and name n  )( residue   27  and name hn ) ( residue   23  and name O )"    14   1   14   93   parsed_2mv6   1   
        15   "assign ( residue   36 and name n  )( residue   36  and name hn ) ( residue   32  and name O )"    15   1   15   93   parsed_2mv6   1   
        16   "assign ( residue   34 and name n  )( residue   34  and name hn ) ( residue   30  and name O )"    16   1   16   93   parsed_2mv6   1   
        17   "assign ( residue   37 and name n  )( residue   37  and name hn ) ( residue   33  and name O )"    17   1   17   93   parsed_2mv6   1   
    stop_

save_





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