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
647916 6ocv 27284 cing 2-parsed STAR distance hydrogen bond simple


data_6ocv_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_6ocv 
    _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_6ocv   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_6ocv 
    _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   6ocv   "Master copy"    parsed_6ocv   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_6ocv 
    _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   6ocv.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"      0   parsed_6ocv   1   
        1   6ocv.mr   .   .    XPLOR/CNS     2   "dipolar coupling"        "Not applicable"    "Not applicable"    157   parsed_6ocv   1   
        1   6ocv.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple             192   parsed_6ocv   1   
        1   6ocv.mr   .   .    XPLOR/CNS     4    distance                 "hydrogen bond"      simple               0   parsed_6ocv   1   
        1   6ocv.mr   .   .    XPLOR/CNS     5    distance                  NOE                 simple               0   parsed_6ocv   1   
        1   6ocv.mr   .   .    XPLOR/CNS     6    distance                  NOE                 simple               0   parsed_6ocv   1   
        1   6ocv.mr   .   .    XPLOR/CNS     7   "dihedral angle"          "Not applicable"    "Not applicable"      0   parsed_6ocv   1   
        1   6ocv.mr   .   .   "MR format"    8   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_6ocv   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_4
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_6ocv 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type    "hydrogen bond" 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            4 
    _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   "# Restraints file 3: hbda.tbl"                                                             1   1    1   29   parsed_6ocv   1   
         2   "assign ( resid    4 and name N ) ( resid    4 and name HN ) ( resid    1 and name O )"     2   1    2   85   parsed_6ocv   1   
         3   "assign ( resid    7 and name N ) ( resid    7 and name HN ) ( resid    3 and name O )"     3   1    3   85   parsed_6ocv   1   
         4   "assign ( resid    8 and name N ) ( resid    8 and name HN ) ( resid    4 and name O )"     4   1    4   85   parsed_6ocv   1   
         5   "assign ( resid    9 and name N ) ( resid    9 and name HN ) ( resid    5 and name O )"     5   1    5   85   parsed_6ocv   1   
         6   "assign ( resid   10 and name N ) ( resid   10 and name HN ) ( resid    6 and name O )"     6   1    6   85   parsed_6ocv   1   
         7   "assign ( resid   11 and name N ) ( resid   11 and name HN ) ( resid    7 and name O )"     7   1    7   85   parsed_6ocv   1   
         8   "assign ( resid   12 and name N ) ( resid   12 and name HN ) ( resid    8 and name O )"     8   1    8   85   parsed_6ocv   1   
         9   "assign ( resid   13 and name N ) ( resid   13 and name HN ) ( resid    9 and name O )"     9   1    9   85   parsed_6ocv   1   
        10   "assign ( resid   14 and name N ) ( resid   14 and name HN ) ( resid   10 and name O )"    10   1   10   85   parsed_6ocv   1   
        11   "assign ( resid   15 and name N ) ( resid   15 and name HN ) ( resid   11 and name O )"    11   1   11   85   parsed_6ocv   1   
        12   "assign ( resid   16 and name N ) ( resid   16 and name HN ) ( resid   12 and name O )"    12   1   12   85   parsed_6ocv   1   
        13   "assign ( resid   17 and name N ) ( resid   17 and name HN ) ( resid   13 and name O )"    13   1   13   85   parsed_6ocv   1   
        14   "assign ( resid   22 and name N ) ( resid   22 and name HN ) ( resid   18 and name O )"    14   1   14   85   parsed_6ocv   1   
        15   "assign ( resid   23 and name N ) ( resid   23 and name HN ) ( resid   19 and name O )"    15   1   15   85   parsed_6ocv   1   
        16   "assign ( resid   24 and name N ) ( resid   24 and name HN ) ( resid   20 and name O )"    16   1   16   85   parsed_6ocv   1   
        17   "assign ( resid   25 and name N ) ( resid   25 and name HN ) ( resid   21 and name O )"    17   1   17   85   parsed_6ocv   1   
        18   "assign ( resid   26 and name N ) ( resid   26 and name HN ) ( resid   22 and name O )"    18   1   18   85   parsed_6ocv   1   
        19   "assign ( resid   27 and name N ) ( resid   27 and name HN ) ( resid   23 and name O )"    19   1   19   85   parsed_6ocv   1   
        20   "assign ( resid   28 and name N ) ( resid   28 and name HN ) ( resid   24 and name O )"    20   1   20   85   parsed_6ocv   1   
        21   "assign ( resid   29 and name N ) ( resid   29 and name HN ) ( resid   25 and name O )"    21   1   21   85   parsed_6ocv   1   
        22   "assign ( resid   49 and name N ) ( resid   49 and name HN ) ( resid   45 and name O )"    22   1   22   85   parsed_6ocv   1   
        23   "assign ( resid   50 and name N ) ( resid   50 and name HN ) ( resid   46 and name O )"    23   1   23   85   parsed_6ocv   1   
        24   "assign ( resid   51 and name N ) ( resid   51 and name HN ) ( resid   47 and name O )"    24   1   24   85   parsed_6ocv   1   
        25   "assign ( resid   52 and name N ) ( resid   52 and name HN ) ( resid   48 and name O )"    25   1   25   85   parsed_6ocv   1   
        26   "assign ( resid   53 and name N ) ( resid   53 and name HN ) ( resid   49 and name O )"    26   1   26   85   parsed_6ocv   1   
        27   "assign ( resid   54 and name N ) ( resid   54 and name HN ) ( resid   50 and name O )"    27   1   27   85   parsed_6ocv   1   
        28   "assign ( resid   55 and name N ) ( resid   55 and name HN ) ( resid   51 and name O )"    28   1   28   85   parsed_6ocv   1   
        29   "assign ( resid   56 and name N ) ( resid   56 and name HN ) ( resid   52 and name O )"    29   1   29   85   parsed_6ocv   1   
        30   "assign ( resid   57 and name N ) ( resid   57 and name HN ) ( resid   53 and name O )"    30   1   30   85   parsed_6ocv   1   
        31   "assign ( resid   58 and name N ) ( resid   58 and name HN ) ( resid   54 and name O )"    31   1   31   85   parsed_6ocv   1   
        32   "assign ( resid   59 and name N ) ( resid   59 and name HN ) ( resid   55 and name O )"    32   1   32   85   parsed_6ocv   1   
        33   "assign ( resid   66 and name N ) ( resid   66 and name HN ) ( resid   62 and name O )"    33   1   33   85   parsed_6ocv   1   
        34   "assign ( resid   67 and name N ) ( resid   67 and name HN ) ( resid   63 and name O )"    34   1   34   85   parsed_6ocv   1   
        35   "assign ( resid   68 and name N ) ( resid   68 and name HN ) ( resid   64 and name O )"    35   1   35   85   parsed_6ocv   1   
        36   "assign ( resid   69 and name N ) ( resid   69 and name HN ) ( resid   65 and name O )"    36   1   36   85   parsed_6ocv   1   
        37   "assign ( resid   70 and name N ) ( resid   70 and name HN ) ( resid   66 and name O )"    37   1   37   85   parsed_6ocv   1   
        38   "assign ( resid   71 and name N ) ( resid   71 and name HN ) ( resid   67 and name O )"    38   1   38   85   parsed_6ocv   1   
        39   "assign ( resid   72 and name N ) ( resid   72 and name HN ) ( resid   68 and name O )"    39   1   39   85   parsed_6ocv   1   
        40   "assign ( resid   73 and name N ) ( resid   73 and name HN ) ( resid   69 and name O )"    40   1   40   85   parsed_6ocv   1   
        41   "assign ( resid   74 and name N ) ( resid   74 and name HN ) ( resid   70 and name O )"    41   1   41   85   parsed_6ocv   1   
        42   "assign ( resid   75 and name N ) ( resid   75 and name HN ) ( resid   71 and name O )"    42   1   42   85   parsed_6ocv   1   
        43   "assign ( resid   76 and name N ) ( resid   76 and name HN ) ( resid   72 and name O )"    43   1   43   85   parsed_6ocv   1   
        44   "assign ( resid   77 and name N ) ( resid   77 and name HN ) ( resid   73 and name O )"    44   1   44   85   parsed_6ocv   1   
        45   "assign ( resid   78 and name N ) ( resid   78 and name HN ) ( resid   74 and name O )"    45   1   45   85   parsed_6ocv   1   
        46   "assign ( resid   79 and name N ) ( resid   79 and name HN ) ( resid   75 and name O )"    46   1   46   85   parsed_6ocv   1   
        47   "assign ( resid   80 and name N ) ( resid   80 and name HN ) ( resid   76 and name O )"    47   1   47   85   parsed_6ocv   1   
        48   "assign ( resid   81 and name N ) ( resid   81 and name HN ) ( resid   77 and name O )"    48   1   48   85   parsed_6ocv   1   
        49   "assign ( resid   82 and name N ) ( resid   82 and name HN ) ( resid   78 and name O )"    49   1   49   85   parsed_6ocv   1   
        50   "assign ( resid   86 and name N ) ( resid   86 and name HN ) ( resid   82 and name O )"    50   1   50   85   parsed_6ocv   1   
        51   "assign ( resid   87 and name N ) ( resid   87 and name HN ) ( resid   83 and name O )"    51   1   51   85   parsed_6ocv   1   
        52   "assign ( resid   88 and name N ) ( resid   88 and name HN ) ( resid   84 and name O )"    52   1   52   85   parsed_6ocv   1   
        53   "assign ( resid   95 and name N ) ( resid   95 and name HN ) ( resid   91 and name O )"    53   1   53   85   parsed_6ocv   1   
        54   "assign ( resid   96 and name N ) ( resid   96 and name HN ) ( resid   92 and name O )"    54   1   54   85   parsed_6ocv   1   
        55   "assign ( resid   97 and name N ) ( resid   97 and name HN ) ( resid   93 and name O )"    55   1   55   85   parsed_6ocv   1   
        56   "assign ( resid   98 and name N ) ( resid   98 and name HN ) ( resid   94 and name O )"    56   1   56   85   parsed_6ocv   1   
        57   "assign ( resid   99 and name N ) ( resid   99 and name HN ) ( resid   95 and name O )"    57   1   57   85   parsed_6ocv   1   
        58   "assign ( resid  102 and name N ) ( resid  102 and name HN ) ( resid   98 and name O )"    58   1   58   85   parsed_6ocv   1   
        59   "assign ( resid  106 and name N ) ( resid  106 and name HN ) ( resid  102 and name O )"    59   1   59   85   parsed_6ocv   1   
        60   "assign ( resid  107 and name N ) ( resid  107 and name HN ) ( resid  103 and name O )"    60   1   60   85   parsed_6ocv   1   
        61   "assign ( resid  108 and name N ) ( resid  108 and name HN ) ( resid  104 and name O )"    61   1   61   85   parsed_6ocv   1   
        62   "assign ( resid  109 and name N ) ( resid  109 and name HN ) ( resid  105 and name O )"    62   1   62   85   parsed_6ocv   1   
        63   "assign ( resid  110 and name N ) ( resid  110 and name HN ) ( resid  106 and name O )"    63   1   63   85   parsed_6ocv   1   
        64   "assign ( resid  111 and name N ) ( resid  111 and name HN ) ( resid  107 and name O )"    64   1   64   85   parsed_6ocv   1   
        65   "assign ( resid  118 and name N ) ( resid  118 and name HN ) ( resid  134 and name O )"    65   1   65   85   parsed_6ocv   1   
        66   "assign ( resid  120 and name N ) ( resid  120 and name HN ) ( resid  132 and name O )"    66   1   66   85   parsed_6ocv   1   
        67   "assign ( resid  122 and name N ) ( resid  122 and name HN ) ( resid  130 and name O )"    67   1   67   85   parsed_6ocv   1   
        68   "assign ( resid  130 and name N ) ( resid  130 and name HN ) ( resid  122 and name O )"    68   1   68   85   parsed_6ocv   1   
        69   "assign ( resid  131 and name N ) ( resid  131 and name HN ) ( resid  175 and name O )"    69   1   69   85   parsed_6ocv   1   
        70   "assign ( resid  132 and name N ) ( resid  132 and name HN ) ( resid  120 and name O )"    70   1   70   85   parsed_6ocv   1   
        71   "assign ( resid  133 and name N ) ( resid  133 and name HN ) ( resid  173 and name O )"    71   1   71   85   parsed_6ocv   1   
        72   "assign ( resid  134 and name N ) ( resid  134 and name HN ) ( resid  118 and name O )"    72   1   72   85   parsed_6ocv   1   
        73   "assign ( resid  135 and name N ) ( resid  135 and name HN ) ( resid  171 and name O )"    73   1   73   85   parsed_6ocv   1   
        74   "assign ( resid  143 and name N ) ( resid  143 and name HN ) ( resid  139 and name O )"    74   1   74   85   parsed_6ocv   1   
        75   "assign ( resid  144 and name N ) ( resid  144 and name HN ) ( resid  140 and name O )"    75   1   75   85   parsed_6ocv   1   
        76   "assign ( resid  145 and name N ) ( resid  145 and name HN ) ( resid  141 and name O )"    76   1   76   85   parsed_6ocv   1   
        77   "assign ( resid  146 and name N ) ( resid  146 and name HN ) ( resid  142 and name O )"    77   1   77   85   parsed_6ocv   1   
        78   "assign ( resid  147 and name N ) ( resid  147 and name HN ) ( resid  143 and name O )"    78   1   78   85   parsed_6ocv   1   
        79   "assign ( resid  148 and name N ) ( resid  148 and name HN ) ( resid  144 and name O )"    79   1   79   85   parsed_6ocv   1   
        80   "assign ( resid  149 and name N ) ( resid  149 and name HN ) ( resid  145 and name O )"    80   1   80   85   parsed_6ocv   1   
        81   "assign ( resid  150 and name N ) ( resid  150 and name HN ) ( resid  146 and name O )"    81   1   81   85   parsed_6ocv   1   
        82   "assign ( resid  151 and name N ) ( resid  151 and name HN ) ( resid  147 and name O )"    82   1   82   85   parsed_6ocv   1   
        83   "assign ( resid  152 and name N ) ( resid  152 and name HN ) ( resid  148 and name O )"    83   1   83   85   parsed_6ocv   1   
        84   "assign ( resid  153 and name N ) ( resid  153 and name HN ) ( resid  149 and name O )"    84   1   84   85   parsed_6ocv   1   
        85   "assign ( resid  154 and name N ) ( resid  154 and name HN ) ( resid  150 and name O )"    85   1   85   85   parsed_6ocv   1   
        86   "assign ( resid  155 and name N ) ( resid  155 and name HN ) ( resid  151 and name O )"    86   1   86   85   parsed_6ocv   1   
        87   "assign ( resid  159 and name N ) ( resid  159 and name HN ) ( resid  178 and name O )"    87   1   87   85   parsed_6ocv   1   
        88   "assign ( resid  161 and name N ) ( resid  161 and name HN ) ( resid  176 and name O )"    88   1   88   85   parsed_6ocv   1   
        89   "assign ( resid  163 and name N ) ( resid  163 and name HN ) ( resid  174 and name O )"    89   1   89   85   parsed_6ocv   1   
        90   "assign ( resid  167 and name N ) ( resid  167 and name HN ) ( resid  163 and name O )"    90   1   90   85   parsed_6ocv   1   
        91   "assign ( resid  171 and name N ) ( resid  171 and name HN ) ( resid  135 and name O )"    91   1   91   85   parsed_6ocv   1   
        92   "assign ( resid  173 and name N ) ( resid  173 and name HN ) ( resid  133 and name O )"    92   1   92   85   parsed_6ocv   1   
        93   "assign ( resid  175 and name N ) ( resid  175 and name HN ) ( resid  131 and name O )"    93   1   93   85   parsed_6ocv   1   
        94   "assign ( resid  176 and name N ) ( resid  176 and name HN ) ( resid  161 and name O )"    94   1   94   85   parsed_6ocv   1   
        95   "assign ( resid  177 and name N ) ( resid  177 and name HN ) ( resid  129 and name O )"    95   1   95   85   parsed_6ocv   1   
        96   "assign ( resid  178 and name N ) ( resid  178 and name HN ) ( resid  159 and name O )"    96   1   96   85   parsed_6ocv   1   
        97   "assign ( resid  179 and name N ) ( resid  179 and name HN ) ( resid  127 and name O )"    97   1   97   85   parsed_6ocv   1   
    stop_

save_





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