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 item_count
579738 2mog 19942 cing 2-parsed STAR dipolar coupling 50


data_2mog_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2mog 
    _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_2mog   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2mog 
    _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   2mog   "Master copy"    parsed_2mog   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2mog 
    _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   2mog.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_2mog   1   
        1   2mog.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             1504   parsed_2mog   1   
        1   2mog.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple               78   parsed_2mog   1   
        1   2mog.mr   .   .    XPLOR/CNS     4   "dipolar coupling"        "Not applicable"    "Not applicable"      50   parsed_2mog   1   
        1   2mog.mr   .   .    XPLOR/CNS     5   "dihedral angle"          "Not applicable"    "Not applicable"       0   parsed_2mog   1   
        1   2mog.mr   .   .   "MR format"    6   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_2mog   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_4
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_2mog 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            4 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    17.01   .   .   .   .   .    6   .   HN    .    6   .   N     parsed_2mog   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.97   .   .   .   .   .    7   .   HN    .    7   .   N     parsed_2mog   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.47   .   .   .   .   .    8   .   HN    .    8   .   N     parsed_2mog   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.85   .   .   .   .   .    9   .   HN    .    9   .   N     parsed_2mog   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.57   .   .   .   .   .   21   .   HN    .   21   .   N     parsed_2mog   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    19.14   .   .   .   .   .   23   .   HN    .   23   .   N     parsed_2mog   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.82   .   .   .   .   .   24   .   HN    .   24   .   N     parsed_2mog   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    14.43   .   .   .   .   .   25   .   HN    .   25   .   N     parsed_2mog   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.08   .   .   .   .   .   26   .   HN    .   26   .   N     parsed_2mog   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.58   .   .   .   .   .   29   .   HN    .   29   .   N     parsed_2mog   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.30   .   .   .   .   .   30   .   HN    .   30   .   N     parsed_2mog   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.05   .   .   .   .   .   33   .   HN    .   33   .   N     parsed_2mog   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.57   .   .   .   .   .   34   .   HN    .   34   .   N     parsed_2mog   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.46   .   .   .   .   .   35   .   HN    .   35   .   N     parsed_2mog   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.87   .   .   .   .   .   36   .   HN    .   36   .   N     parsed_2mog   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.66   .   .   .   .   .   37   .   HN    .   37   .   N     parsed_2mog   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.15   .   .   .   .   .   39   .   HN    .   39   .   N     parsed_2mog   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    18.08   .   .   .   .   .   40   .   HN    .   40   .   N     parsed_2mog   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.81   .   .   .   .   .   41   .   HN    .   41   .   N     parsed_2mog   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    13.67   .   .   .   .   .   42   .   HN    .   42   .   N     parsed_2mog   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    15.80   .   .   .   .   .   43   .   HN    .   43   .   N     parsed_2mog   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.94   .   .   .   .   .   44   .   HN    .   44   .   N     parsed_2mog   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.94   .   .   .   .   .   46   .   HN    .   46   .   N     parsed_2mog   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    16.46   .   .   .   .   .   48   .   HN    .   48   .   N     parsed_2mog   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    15.39   .   .   .   .   .   49   .   HN    .   49   .   N     parsed_2mog   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.42   .   .   .   .   .   51   .   HN    .   51   .   N     parsed_2mog   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.96   .   .   .   .   .   52   .   HN    .   52   .   N     parsed_2mog   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.23   .   .   .   .   .   53   .   HN    .   53   .   N     parsed_2mog   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.20   .   .   .   .   .   54   .   HN    .   54   .   N     parsed_2mog   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.44   .   .   .   .   .   57   .   HN    .   57   .   N     parsed_2mog   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -13.92   .   .   .   .   .   58   .   HN    .   58   .   N     parsed_2mog   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.66   .   .   .   .   .   60   .   HN    .   60   .   N     parsed_2mog   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    16.40   .   .   .   .   .   61   .   HN    .   61   .   N     parsed_2mog   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.16   .   .   .   .   .   62   .   HN    .   62   .   N     parsed_2mog   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    15.65   .   .   .   .   .   63   .   HN    .   63   .   N     parsed_2mog   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.54   .   .   .   .   .   64   .   HN    .   64   .   N     parsed_2mog   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    18.18   .   .   .   .   .   65   .   HN    .   65   .   N     parsed_2mog   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    16.76   .   .   .   .   .   72   .   HN    .   72   .   N     parsed_2mog   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.14   .   .   .   .   .   78   .   HN    .   78   .   N     parsed_2mog   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.08   .   .   .   .   .   79   .   HN    .   79   .   N     parsed_2mog   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.70   .   .   .   .   .   82   .   HN    .   82   .   N     parsed_2mog   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.40   .   .   .   .   .   83   .   HN    .   83   .   N     parsed_2mog   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.54   .   .   .   .   .   84   .   HN    .   84   .   N     parsed_2mog   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.08   .   .   .   .   .   86   .   HN    .   86   .   N     parsed_2mog   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.46   .   .   .   .   .   87   .   HN    .   87   .   N     parsed_2mog   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    18.99   .   .   .   .   .   88   .   HN    .   88   .   N     parsed_2mog   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    17.47   .   .   .   .   .   90   .   HN    .   90   .   N     parsed_2mog   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.34   .   .   .   .   .   94   .   HN    .   94   .   N     parsed_2mog   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.51   .   .   .   .   .   95   .   HN    .   95   .   N     parsed_2mog   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.54   .   .   .   .   .   45   .   HE1   .   45   .   NE1   parsed_2mog   1   
    stop_

save_





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