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
515461 1cmz 4407 cing recoord 2-parsed STAR dipolar coupling 70


data_1cmz_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1cmz 
    _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_1cmz   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1cmz 
    _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   1cmz   "Master copy"    parsed_1cmz   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1cmz 
    _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   1cmz.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_1cmz   1   
        1   1cmz.mr   .   .   "MR format"    2   "dipolar coupling"        "Not applicable"    "Not applicable"       0   parsed_1cmz   1   
        1   1cmz.mr   .   .    n/a           3    comment                  "Not applicable"    "Not applicable"       0   parsed_1cmz   1   
        1   1cmz.mr   .   .    XPLOR/CNS     4    distance                  NOE                 ambi               1357   parsed_1cmz   1   
        1   1cmz.mr   .   .    XPLOR/CNS     5    distance                 "hydrogen bond"      simple               70   parsed_1cmz   1   
        1   1cmz.mr   .   .    XPLOR/CNS     6   "dihedral angle"          "Not applicable"    "Not applicable"     146   parsed_1cmz   1   
        1   1cmz.mr   .   .    XPLOR/CNS     7   "dipolar coupling"        "Not applicable"    "Not applicable"      70   parsed_1cmz   1   
        1   1cmz.mr   .   .    XPLOR/CNS     8   "dipolar coupling"        "Not applicable"    "Not applicable"       0   parsed_1cmz   1   
        1   1cmz.mr   .   .   "MR format"    9   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_1cmz   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_7
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_1cmz 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.347      7.347     7.347   .   .   .    82   .   N   .    82   .   HN   parsed_1cmz   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.445     -2.445    -2.445   .   .   .    84   .   N   .    84   .   HN   parsed_1cmz   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.966      7.966     7.966   .   .   .    86   .   N   .    86   .   HN   parsed_1cmz   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.411      3.411     3.411   .   .   .    87   .   N   .    87   .   HN   parsed_1cmz   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.495      9.495     9.495   .   .   .    90   .   N   .    90   .   HN   parsed_1cmz   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.930     10.930    10.930   .   .   .    91   .   N   .    91   .   HN   parsed_1cmz   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.999      7.999     7.999   .   .   .    92   .   N   .    92   .   HN   parsed_1cmz   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.554      3.554     3.554   .   .   .    93   .   N   .    93   .   HN   parsed_1cmz   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.233      8.233     8.233   .   .   .    94   .   N   .    94   .   HN   parsed_1cmz   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.466     10.466    10.466   .   .   .    95   .   N   .    95   .   HN   parsed_1cmz   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.042      6.042     6.042   .   .   .    97   .   N   .    97   .   HN   parsed_1cmz   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.604      8.604     8.604   .   .   .   100   .   N   .   100   .   HN   parsed_1cmz   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.152      9.152     9.152   .   .   .   101   .   N   .   101   .   HN   parsed_1cmz   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.792      4.792     4.792   .   .   .   102   .   N   .   102   .   HN   parsed_1cmz   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.319      8.319     8.319   .   .   .   104   .   N   .   104   .   HN   parsed_1cmz   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.992      7.992     7.992   .   .   .   105   .   N   .   105   .   HN   parsed_1cmz   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.499      4.499     4.499   .   .   .   106   .   N   .   106   .   HN   parsed_1cmz   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.002      8.002     8.002   .   .   .   108   .   N   .   108   .   HN   parsed_1cmz   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.596      7.596     7.596   .   .   .   109   .   N   .   109   .   HN   parsed_1cmz   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.544      4.544     4.544   .   .   .   111   .   N   .   111   .   HN   parsed_1cmz   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.993      0.993     0.993   .   .   .   112   .   N   .   112   .   HN   parsed_1cmz   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.385    -14.385   -14.385   .   .   .   113   .   N   .   113   .   HN   parsed_1cmz   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.453      9.453     9.453   .   .   .   114   .   N   .   114   .   HN   parsed_1cmz   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.492      8.492     8.492   .   .   .   115   .   N   .   115   .   HN   parsed_1cmz   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.371      5.371     5.371   .   .   .   117   .   N   .   117   .   HN   parsed_1cmz   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.542      2.542     2.542   .   .   .   119   .   N   .   119   .   HN   parsed_1cmz   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.910      4.910     4.910   .   .   .   121   .   N   .   121   .   HN   parsed_1cmz   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.695     -0.695    -0.695   .   .   .   124   .   N   .   124   .   HN   parsed_1cmz   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.986      2.986     2.986   .   .   .   126   .   N   .   126   .   HN   parsed_1cmz   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.278    -11.278   -11.278   .   .   .   127   .   N   .   127   .   HN   parsed_1cmz   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.097      7.097     7.097   .   .   .   128   .   N   .   128   .   HN   parsed_1cmz   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.480      3.480     3.480   .   .   .   131   .   N   .   131   .   HN   parsed_1cmz   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.000      7.000     7.000   .   .   .   134   .   N   .   134   .   HN   parsed_1cmz   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.175      2.175     2.175   .   .   .   135   .   N   .   135   .   HN   parsed_1cmz   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.403      1.403     1.403   .   .   .   136   .   N   .   136   .   HN   parsed_1cmz   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.519      7.519     7.519   .   .   .   138   .   N   .   138   .   HN   parsed_1cmz   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.499     -0.499    -0.499   .   .   .   139   .   N   .   139   .   HN   parsed_1cmz   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.988      1.988     1.988   .   .   .   143   .   N   .   143   .   HN   parsed_1cmz   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.823      7.823     7.823   .   .   .   145   .   N   .   145   .   HN   parsed_1cmz   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.647     -3.647    -3.647   .   .   .   146   .   N   .   146   .   HN   parsed_1cmz   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.830     -3.830    -3.830   .   .   .   162   .   N   .   162   .   HN   parsed_1cmz   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.647    -11.647   -11.647   .   .   .   164   .   N   .   164   .   HN   parsed_1cmz   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.007     -3.007    -3.007   .   .   .   165   .   N   .   165   .   HN   parsed_1cmz   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.181     -2.181    -2.181   .   .   .   166   .   N   .   166   .   HN   parsed_1cmz   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.094     -8.094    -8.094   .   .   .   178   .   N   .   178   .   HN   parsed_1cmz   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.918    -11.918   -11.918   .   .   .   181   .   N   .   181   .   HN   parsed_1cmz   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.623    -12.623   -12.623   .   .   .   184   .   N   .   184   .   HN   parsed_1cmz   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -17.484    -17.484   -17.484   .   .   .   186   .   N   .   186   .   HN   parsed_1cmz   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.854    -15.854   -15.854   .   .   .   187   .   N   .   187   .   HN   parsed_1cmz   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.967    -10.967   -10.967   .   .   .   188   .   N   .   188   .   HN   parsed_1cmz   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -18.943    -18.943   -18.943   .   .   .   190   .   N   .   190   .   HN   parsed_1cmz   1   
        52   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.872    -12.872   -12.872   .   .   .   191   .   N   .   191   .   HN   parsed_1cmz   1   
        53   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.675     -4.675    -4.675   .   .   .   192   .   N   .   192   .   HN   parsed_1cmz   1   
        54   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.207    -10.207   -10.207   .   .   .   193   .   N   .   193   .   HN   parsed_1cmz   1   
        55   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -19.095    -19.095   -19.095   .   .   .   195   .   N   .   195   .   HN   parsed_1cmz   1   
        56   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.213     -8.213    -8.213   .   .   .   196   .   N   .   196   .   HN   parsed_1cmz   1   
        57   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.693     -1.693    -1.693   .   .   .   197   .   N   .   197   .   HN   parsed_1cmz   1   
        58   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.864    -14.864   -14.864   .   .   .   198   .   N   .   198   .   HN   parsed_1cmz   1   
        59   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.953      5.953     5.953   .   .   .   202   .   N   .   202   .   HN   parsed_1cmz   1   
        60   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.043      4.043     4.043   .   .   .   203   .   N   .   203   .   HN   parsed_1cmz   1   
        61   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.568    -12.568   -12.568   .   .   .   204   .   N   .   204   .   HN   parsed_1cmz   1   
        62   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.147      1.147     1.147   .   .   .   205   .   N   .   205   .   HN   parsed_1cmz   1   
        63   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.239      6.239     6.239   .   .   .   206   .   N   .   206   .   HN   parsed_1cmz   1   
        64   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.032      5.032   105.032   .   .   .   148   .   N   .   148   .   HN   parsed_1cmz   1   
        65   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.271     11.271   111.271   .   .   .   151   .   N   .   151   .   HN   parsed_1cmz   1   
        66   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.926   -107.926    -7.926   .   .   .   156   .   N   .   156   .   HN   parsed_1cmz   1   
        67   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.739      4.739   104.739   .   .   .   157   .   N   .   157   .   HN   parsed_1cmz   1   
        68   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.429      5.429   105.429   .   .   .   158   .   N   .   158   .   HN   parsed_1cmz   1   
        69   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.088      0.088   100.088   .   .   .   173   .   N   .   173   .   HN   parsed_1cmz   1   
        70   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.445      5.445   105.445   .   .   .   177   .   N   .   177   .   HN   parsed_1cmz   1   
    stop_

save_





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