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
471256 2kzn 17008 cing 2-parsed STAR dipolar coupling 85


data_2kzn_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2kzn 
    _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_2kzn   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2kzn 
    _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   2kzn   "Master copy"    parsed_2kzn   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2kzn 
    _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   2kzn.mr   .   .   "MR format"     1    comment                  "Not applicable"    "Not applicable"      0   parsed_2kzn   1   
        1   2kzn.mr   .   .    XPLOR/CNS      2    distance                  NOE                 simple             645   parsed_2kzn   1   
        1   2kzn.mr   .   .    XPLOR/CNS      3   "dihedral angle"          "Not applicable"    "Not applicable"    235   parsed_2kzn   1   
        1   2kzn.mr   .   .    XPLOR/CNS      4   "dipolar coupling"        "Not applicable"    "Not applicable"     85   parsed_2kzn   1   
        1   2kzn.mr   .   .    XPLOR/CNS      5   "dihedral angle"          "Not applicable"    "Not applicable"      0   parsed_2kzn   1   
        1   2kzn.mr   .   .    XPLOR/CNS      6    distance                  NOE                 simple               0   parsed_2kzn   1   
        1   2kzn.mr   .   .    XPLOR/CNS      7   "dipolar coupling"        "Not applicable"    "Not applicable"      0   parsed_2kzn   1   
        1   2kzn.mr   .   .    STAR           8    sequence                 "Not applicable"    "Not applicable"      0   parsed_2kzn   1   
        1   2kzn.mr   .   .    STAR           9   "chemical shift"          "Not applicable"    "Not applicable"      0   parsed_2kzn   1   
        1   2kzn.mr   .   .   "MR format"    10   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_2kzn   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_4
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_2kzn 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.4630   .   .   .   .   .     5   .   N   .     5   .   HN   parsed_2kzn   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.7870   .   .   .   .   .     6   .   N   .     6   .   HN   parsed_2kzn   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.8100   .   .   .   .   .     7   .   N   .     7   .   HN   parsed_2kzn   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.4060   .   .   .   .   .     8   .   N   .     8   .   HN   parsed_2kzn   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.8500   .   .   .   .   .     9   .   N   .     9   .   HN   parsed_2kzn   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.3510   .   .   .   .   .    10   .   N   .    10   .   HN   parsed_2kzn   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.5320   .   .   .   .   .    12   .   N   .    12   .   HN   parsed_2kzn   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.3980   .   .   .   .   .    14   .   N   .    14   .   HN   parsed_2kzn   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.5910   .   .   .   .   .    15   .   N   .    15   .   HN   parsed_2kzn   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.4830   .   .   .   .   .    16   .   N   .    16   .   HN   parsed_2kzn   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.0430   .   .   .   .   .    17   .   N   .    17   .   HN   parsed_2kzn   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.9870   .   .   .   .   .    18   .   N   .    18   .   HN   parsed_2kzn   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.5420   .   .   .   .   .    19   .   N   .    19   .   HN   parsed_2kzn   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.5420   .   .   .   .   .    20   .   N   .    20   .   HN   parsed_2kzn   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.5020   .   .   .   .   .    22   .   N   .    22   .   HN   parsed_2kzn   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.6940   .   .   .   .   .    25   .   N   .    25   .   HN   parsed_2kzn   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.1900   .   .   .   .   .    26   .   N   .    26   .   HN   parsed_2kzn   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.6480   .   .   .   .   .    39   .   N   .    39   .   HN   parsed_2kzn   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.2020   .   .   .   .   .    40   .   N   .    40   .   HN   parsed_2kzn   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.6250   .   .   .   .   .    41   .   N   .    41   .   HN   parsed_2kzn   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.5160   .   .   .   .   .    43   .   N   .    43   .   HN   parsed_2kzn   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.2420   .   .   .   .   .    44   .   N   .    44   .   HN   parsed_2kzn   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.9930   .   .   .   .   .    45   .   N   .    45   .   HN   parsed_2kzn   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.3410   .   .   .   .   .    47   .   N   .    47   .   HN   parsed_2kzn   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.3370   .   .   .   .   .    48   .   N   .    48   .   HN   parsed_2kzn   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.3810   .   .   .   .   .    49   .   N   .    49   .   HN   parsed_2kzn   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5030   .   .   .   .   .    51   .   N   .    51   .   HN   parsed_2kzn   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.1480   .   .   .   .   .    52   .   N   .    52   .   HN   parsed_2kzn   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.3870   .   .   .   .   .    53   .   N   .    53   .   HN   parsed_2kzn   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.5620   .   .   .   .   .    54   .   N   .    54   .   HN   parsed_2kzn   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.8390   .   .   .   .   .    55   .   N   .    55   .   HN   parsed_2kzn   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.6180   .   .   .   .   .    57   .   N   .    57   .   HN   parsed_2kzn   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.7100   .   .   .   .   .    68   .   N   .    68   .   HN   parsed_2kzn   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.2450   .   .   .   .   .    69   .   N   .    69   .   HN   parsed_2kzn   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5230   .   .   .   .   .    71   .   N   .    71   .   HN   parsed_2kzn   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.1270   .   .   .   .   .    72   .   N   .    72   .   HN   parsed_2kzn   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.8800   .   .   .   .   .    73   .   N   .    73   .   HN   parsed_2kzn   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.0950   .   .   .   .   .    74   .   N   .    74   .   HN   parsed_2kzn   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.7290   .   .   .   .   .    75   .   N   .    75   .   HN   parsed_2kzn   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.0010   .   .   .   .   .    76   .   N   .    76   .   HN   parsed_2kzn   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.6220   .   .   .   .   .    77   .   N   .    77   .   HN   parsed_2kzn   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.9320   .   .   .   .   .    78   .   N   .    78   .   HN   parsed_2kzn   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.2090   .   .   .   .   .    79   .   N   .    79   .   HN   parsed_2kzn   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.9010   .   .   .   .   .    80   .   N   .    80   .   HN   parsed_2kzn   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.6100   .   .   .   .   .    87   .   N   .    87   .   HN   parsed_2kzn   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.9110   .   .   .   .   .    88   .   N   .    88   .   HN   parsed_2kzn   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.4900   .   .   .   .   .    89   .   N   .    89   .   HN   parsed_2kzn   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.7950   .   .   .   .   .    90   .   N   .    90   .   HN   parsed_2kzn   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.3720   .   .   .   .   .    91   .   N   .    91   .   HN   parsed_2kzn   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.6300   .   .   .   .   .    92   .   N   .    92   .   HN   parsed_2kzn   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.6470   .   .   .   .   .    93   .   N   .    93   .   HN   parsed_2kzn   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.9380   .   .   .   .   .    94   .   N   .    94   .   HN   parsed_2kzn   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.8940   .   .   .   .   .    95   .   N   .    95   .   HN   parsed_2kzn   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.2510   .   .   .   .   .    98   .   N   .    98   .   HN   parsed_2kzn   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.4500   .   .   .   .   .    99   .   N   .    99   .   HN   parsed_2kzn   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.6600   .   .   .   .   .   100   .   N   .   100   .   HN   parsed_2kzn   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.6570   .   .   .   .   .   102   .   N   .   102   .   HN   parsed_2kzn   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.4180   .   .   .   .   .   103   .   N   .   103   .   HN   parsed_2kzn   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.1720   .   .   .   .   .   105   .   N   .   105   .   HN   parsed_2kzn   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.4030   .   .   .   .   .   106   .   N   .   106   .   HN   parsed_2kzn   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.0630   .   .   .   .   .   108   .   N   .   108   .   HN   parsed_2kzn   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.4390   .   .   .   .   .   110   .   N   .   110   .   HN   parsed_2kzn   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.0220   .   .   .   .   .   111   .   N   .   111   .   HN   parsed_2kzn   1   
        64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.4900   .   .   .   .   .   112   .   N   .   112   .   HN   parsed_2kzn   1   
        65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.9680   .   .   .   .   .   115   .   N   .   115   .   HN   parsed_2kzn   1   
        66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.6810   .   .   .   .   .   116   .   N   .   116   .   HN   parsed_2kzn   1   
        67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.0780   .   .   .   .   .   117   .   N   .   117   .   HN   parsed_2kzn   1   
        68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.6630   .   .   .   .   .   120   .   N   .   120   .   HN   parsed_2kzn   1   
        69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.2750   .   .   .   .   .   121   .   N   .   121   .   HN   parsed_2kzn   1   
        70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.2850   .   .   .   .   .   123   .   N   .   123   .   HN   parsed_2kzn   1   
        71   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.3950   .   .   .   .   .   124   .   N   .   124   .   HN   parsed_2kzn   1   
        72   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.2070   .   .   .   .   .   126   .   N   .   126   .   HN   parsed_2kzn   1   
        73   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.3720   .   .   .   .   .   127   .   N   .   127   .   HN   parsed_2kzn   1   
        74   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.2270   .   .   .   .   .   129   .   N   .   129   .   HN   parsed_2kzn   1   
        75   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.0060   .   .   .   .   .   130   .   N   .   130   .   HN   parsed_2kzn   1   
        76   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.8710   .   .   .   .   .   131   .   N   .   131   .   HN   parsed_2kzn   1   
        77   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.5690   .   .   .   .   .   132   .   N   .   132   .   HN   parsed_2kzn   1   
        78   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.1220   .   .   .   .   .   133   .   N   .   133   .   HN   parsed_2kzn   1   
        79   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.3890   .   .   .   .   .   134   .   N   .   134   .   HN   parsed_2kzn   1   
        80   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.4530   .   .   .   .   .   135   .   N   .   135   .   HN   parsed_2kzn   1   
        81   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.7260   .   .   .   .   .   136   .   N   .   136   .   HN   parsed_2kzn   1   
        82   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.8710   .   .   .   .   .   137   .   N   .   137   .   HN   parsed_2kzn   1   
        83   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.3190   .   .   .   .   .   138   .   N   .   138   .   HN   parsed_2kzn   1   
        84   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.2350   .   .   .   .   .   140   .   N   .   140   .   HN   parsed_2kzn   1   
        85   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.7570   .   .   .   .   .   141   .   N   .   141   .   HN   parsed_2kzn   1   
    stop_


    loop_
        _RDC_constraint_parse_err.ID 
        _RDC_constraint_parse_err.Content 
        _RDC_constraint_parse_err.Begin_line 
        _RDC_constraint_parse_err.Begin_column 
        _RDC_constraint_parse_err.End_line 
        _RDC_constraint_parse_err.End_column 
        _RDC_constraint_parse_err.Entry_ID 
        _RDC_constraint_parse_err.RDC_constraint_list_ID 

        1   "#rdc constraints"    1   1   1   16   parsed_2kzn   1   
    stop_

save_





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