NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing in_recoord stage program type item_count
515583 1m12 5465 cing recoord 2-parsed STAR dipolar coupling 78


data_1m12_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1m12 
    _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_1m12   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1m12 
    _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   1m12   "Master copy"    parsed_1m12   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1m12 
    _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   1m12.mr   .   .   "MR format"     1    comment                  "Not applicable"      "Not applicable"       0   parsed_1m12   1   
        1   1m12.mr   .   .    n/a            2    comment                  "Not applicable"      "Not applicable"       0   parsed_1m12   1   
        1   1m12.mr   .   .    PDB            3    coordinate               "alignment tensor"    "Not applicable"       0   parsed_1m12   1   
        1   1m12.mr   .   .    XPLOR/CNS      4    distance                  NOE                   ambi               1815   parsed_1m12   1   
        1   1m12.mr   .   .    XPLOR/CNS      5    distance                 "hydrogen bond"        simple               56   parsed_1m12   1   
        1   1m12.mr   .   .    XPLOR/CNS      6   "dihedral angle"          "Not applicable"      "Not applicable"     134   parsed_1m12   1   
        1   1m12.mr   .   .    XPLOR/CNS      7   "dipolar coupling"        "Not applicable"      "Not applicable"      78   parsed_1m12   1   
        1   1m12.mr   .   .    XPLOR/CNS      8   "dipolar coupling"        "Not applicable"      "Not applicable"       0   parsed_1m12   1   
        1   1m12.mr   .   .    XPLOR/CNS      9   "dipolar coupling"        "Not applicable"      "Not applicable"       0   parsed_1m12   1   
        1   1m12.mr   .   .   "MR format"    10   "nomenclature mapping"    "Not applicable"      "Not applicable"       0   parsed_1m12   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_7
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_1m12 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            7 
    _RDC_constraint_list.Details            "Generated by Wattos" 

    loop_
        _RDC_constraint.ID 
        _RDC_constraint.Assembly_atom_ID_1 
        _RDC_constraint.Entity_assembly_ID_1 
        _RDC_constraint.Entity_ID_1 
        _RDC_constraint.Comp_index_ID_1 
        _RDC_constraint.Seq_ID_1 
        _RDC_constraint.Comp_ID_1 
        _RDC_constraint.Atom_ID_1 
        _RDC_constraint.Resonance_ID_1 
        _RDC_constraint.Assembly_atom_ID_2 
        _RDC_constraint.Entity_assembly_ID_2 
        _RDC_constraint.Entity_ID_2 
        _RDC_constraint.Comp_index_ID_2 
        _RDC_constraint.Seq_ID_2 
        _RDC_constraint.Comp_ID_2 
        _RDC_constraint.Atom_ID_2 
        _RDC_constraint.Resonance_ID_2 
        _RDC_constraint.RDC_val 
        _RDC_constraint.RDC_lower_bound 
        _RDC_constraint.RDC_upper_bound 
        _RDC_constraint.RDC_val_err 
        _RDC_constraint.Source_experiment_ID 
        _RDC_constraint.Auth_asym_ID_1 
        _RDC_constraint.Auth_seq_ID_1 
        _RDC_constraint.Auth_comp_ID_1 
        _RDC_constraint.Auth_atom_ID_1 
        _RDC_constraint.Auth_asym_ID_2 
        _RDC_constraint.Auth_seq_ID_2 
        _RDC_constraint.Auth_comp_ID_2 
        _RDC_constraint.Auth_atom_ID_2 
        _RDC_constraint.Entry_ID 
        _RDC_constraint.RDC_constraint_list_ID 

         1   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.422    -3.422    -3.422   .   .   .    4   .   N   .    4   .   HN   parsed_1m12   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -19.158   -19.158   -19.158   .   .   .    5   .   N   .    5   .   HN   parsed_1m12   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -26.778   -26.778   -26.778   .   .   .    6   .   N   .    6   .   HN   parsed_1m12   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.916   -16.916   -16.916   .   .   .    7   .   N   .    7   .   HN   parsed_1m12   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.980   -11.980   -11.980   .   .   .    8   .   N   .    8   .   HN   parsed_1m12   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -22.072   -22.072   -22.072   .   .   .    9   .   N   .    9   .   HN   parsed_1m12   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -28.033   -28.033   -28.033   .   .   .   10   .   N   .   10   .   HN   parsed_1m12   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.925   -12.925   -12.925   .   .   .   11   .   N   .   11   .   HN   parsed_1m12   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.100   -15.100   -15.100   .   .   .   12   .   N   .   12   .   HN   parsed_1m12   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -26.047   -26.047   -26.047   .   .   .   13   .   N   .   13   .   HN   parsed_1m12   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -21.806   -21.806   -21.806   .   .   .   14   .   N   .   14   .   HN   parsed_1m12   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.833    -9.833    -9.833   .   .   .   15   .   N   .   15   .   HN   parsed_1m12   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -20.926   -20.926   -20.926   .   .   .   16   .   N   .   16   .   HN   parsed_1m12   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -29.668   -29.668   -29.668   .   .   .   17   .   N   .   17   .   HN   parsed_1m12   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.605   -14.605   -14.605   .   .   .   18   .   N   .   18   .   HN   parsed_1m12   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -17.955   -17.955   -17.955   .   .   .   19   .   N   .   19   .   HN   parsed_1m12   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -24.055   -24.055   -24.055   .   .   .   20   .   N   .   20   .   HN   parsed_1m12   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -25.281   -25.281   -25.281   .   .   .   21   .   N   .   21   .   HN   parsed_1m12   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.083     7.083     7.083   .   .   .   22   .   N   .   22   .   HN   parsed_1m12   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.683   -10.683   -10.683   .   .   .   23   .   N   .   23   .   HN   parsed_1m12   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    24.742    24.742    24.742   .   .   .   24   .   N   .   24   .   HN   parsed_1m12   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.895    -3.895    -3.895   .   .   .   25   .   N   .   25   .   HN   parsed_1m12   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -20.154   -20.154   -20.154   .   .   .   26   .   N   .   26   .   HN   parsed_1m12   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -20.312   -20.312   -20.312   .   .   .   27   .   N   .   27   .   HN   parsed_1m12   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.675     3.675     3.675   .   .   .   28   .   N   .   28   .   HN   parsed_1m12   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.847   -11.847   -11.847   .   .   .   29   .   N   .   29   .   HN   parsed_1m12   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -27.528   -27.528   -27.528   .   .   .   30   .   N   .   30   .   HN   parsed_1m12   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    40.551    40.551    40.551   .   .   .   41   .   N   .   41   .   HN   parsed_1m12   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.392    12.392    12.392   .   .   .   42   .   N   .   42   .   HN   parsed_1m12   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    24.033    24.033    24.033   .   .   .   43   .   N   .   43   .   HN   parsed_1m12   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    26.529    26.529    26.529   .   .   .   44   .   N   .   44   .   HN   parsed_1m12   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.094    -0.094    -0.094   .   .   .   45   .   N   .   45   .   HN   parsed_1m12   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    14.282    14.282    14.282   .   .   .   46   .   N   .   46   .   HN   parsed_1m12   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    26.114    26.114    26.114   .   .   .   47   .   N   .   47   .   HN   parsed_1m12   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.039    10.039    10.039   .   .   .   48   .   N   .   48   .   HN   parsed_1m12   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.726     2.726     2.726   .   .   .   49   .   N   .   49   .   HN   parsed_1m12   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    28.218    28.218    28.218   .   .   .   50   .   N   .   50   .   HN   parsed_1m12   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    19.717    19.717    19.717   .   .   .   51   .   N   .   51   .   HN   parsed_1m12   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.053     3.053     3.053   .   .   .   52   .   N   .   52   .   HN   parsed_1m12   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.853     8.853     8.853   .   .   .   53   .   N   .   53   .   HN   parsed_1m12   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    28.194    28.194    28.194   .   .   .   54   .   N   .   54   .   HN   parsed_1m12   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -23.614   -23.614   -23.614   .   .   .   55   .   N   .   55   .   HN   parsed_1m12   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -29.325   -29.325   -29.325   .   .   .   56   .   N   .   56   .   HN   parsed_1m12   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -25.743   -25.743   -25.743   .   .   .   57   .   N   .   57   .   HN   parsed_1m12   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -20.514   -20.514   -20.514   .   .   .   58   .   N   .   58   .   HN   parsed_1m12   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -29.608   -29.608   -29.608   .   .   .   59   .   N   .   59   .   HN   parsed_1m12   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -31.693   -31.693   -31.693   .   .   .   60   .   N   .   60   .   HN   parsed_1m12   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -23.070   -23.070   -23.070   .   .   .   62   .   N   .   62   .   HN   parsed_1m12   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -26.263   -26.263   -26.263   .   .   .   64   .   N   .   64   .   HN   parsed_1m12   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.108    10.108    10.108   .   .   .   65   .   N   .   65   .   HN   parsed_1m12   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.288   -16.288   -16.288   .   .   .   66   .   N   .   66   .   HN   parsed_1m12   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -21.882   -21.882   -21.882   .   .   .   70   .   N   .   70   .   HN   parsed_1m12   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.625    12.625    12.625   .   .   .   71   .   N   .   71   .   HN   parsed_1m12   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.849     9.849     9.849   .   .   .   72   .   N   .   72   .   HN   parsed_1m12   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -17.801   -17.801   -17.801   .   .   .   73   .   N   .   73   .   HN   parsed_1m12   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.965     8.965     8.965   .   .   .   74   .   N   .   74   .   HN   parsed_1m12   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    21.498    21.498    21.498   .   .   .   75   .   N   .   75   .   HN   parsed_1m12   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -28.883   -28.883   -28.883   .   .   .   76   .   N   .   76   .   HN   parsed_1m12   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -31.487   -31.487   -31.487   .   .   .   77   .   N   .   77   .   HN   parsed_1m12   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.701     9.701     9.701   .   .   .   78   .   N   .   78   .   HN   parsed_1m12   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.350   -57.350    -7.350   .   .   .    2   .   N   .    2   .   HN   parsed_1m12   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -22.657   -72.657   -22.657   .   .   .    3   .   N   .    3   .   HN   parsed_1m12   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.608   -52.608    -2.608   .   .   .   31   .   N   .   31   .   HN   parsed_1m12   1   
        64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.452     6.452    56.452   .   .   .   32   .   N   .   32   .   HN   parsed_1m12   1   
        65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -17.315   -67.315   -17.315   .   .   .   33   .   N   .   33   .   HN   parsed_1m12   1   
        66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.084   -65.084   -15.084   .   .   .   34   .   N   .   34   .   HN   parsed_1m12   1   
        67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    20.195    20.195    70.195   .   .   .   35   .   N   .   35   .   HN   parsed_1m12   1   
        68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.143     1.143    51.143   .   .   .   36   .   N   .   36   .   HN   parsed_1m12   1   
        69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.950   -61.950   -11.950   .   .   .   37   .   N   .   37   .   HN   parsed_1m12   1   
        70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    29.164    29.164    79.164   .   .   .   38   .   N   .   38   .   HN   parsed_1m12   1   
        71   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.977   -57.977    -7.977   .   .   .   39   .   N   .   39   .   HN   parsed_1m12   1   
        72   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -21.788   -71.788   -21.788   .   .   .   61   .   N   .   61   .   HN   parsed_1m12   1   
        73   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    27.612    27.612    77.612   .   .   .   67   .   N   .   67   .   HN   parsed_1m12   1   
        74   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -29.531   -79.531   -29.531   .   .   .   69   .   N   .   69   .   HN   parsed_1m12   1   
        75   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    15.488    15.488    65.488   .   .   .   80   .   N   .   80   .   HN   parsed_1m12   1   
        76   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.928   -52.928    -2.928   .   .   .   81   .   N   .   81   .   HN   parsed_1m12   1   
        77   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.947     2.947    52.947   .   .   .   82   .   N   .   82   .   HN   parsed_1m12   1   
        78   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.008   -51.008    -1.008   .   .   .   84   .   N   .   84   .   HN   parsed_1m12   1   
    stop_

save_





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