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
585283 4uzx 25214 cing 2-parsed STAR dipolar coupling 45


data_4uzx_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_4uzx 
    _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_4uzx   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_4uzx 
    _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   4uzx   "Master copy"    parsed_4uzx   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_4uzx 
    _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   4uzx.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_4uzx   1   
        1   4uzx.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             1492   parsed_4uzx   1   
        1   4uzx.mr   .   .    XPLOR/CNS     3    distance                 "hydrogen bond"      simple               64   parsed_4uzx   1   
        1   4uzx.mr   .   .    XPLOR/CNS     4   "dihedral angle"          "Not applicable"    "Not applicable"      13   parsed_4uzx   1   
        1   4uzx.mr   .   .    XPLOR/CNS     5   "dihedral angle"          "Not applicable"    "Not applicable"     110   parsed_4uzx   1   
        1   4uzx.mr   .   .    XPLOR/CNS     6   "dipolar coupling"        "Not applicable"    "Not applicable"      45   parsed_4uzx   1   
        1   4uzx.mr   .   .   "MR format"    7   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_4uzx   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_6
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_4uzx 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            6 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.440   .   .   .   .   .   120   .   N   .   120   .   HN   parsed_4uzx   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    15.010   .   .   .   .   .   121   .   N   .   121   .   HN   parsed_4uzx   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -19.920   .   .   .   .   .   123   .   N   .   123   .   HN   parsed_4uzx   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -17.470   .   .   .   .   .   124   .   N   .   124   .   HN   parsed_4uzx   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.500   .   .   .   .   .   128   .   N   .   128   .   HN   parsed_4uzx   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.390   .   .   .   .   .   129   .   N   .   129   .   HN   parsed_4uzx   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.640   .   .   .   .   .   130   .   N   .   130   .   HN   parsed_4uzx   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.130   .   .   .   .   .   132   .   N   .   132   .   HN   parsed_4uzx   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.720   .   .   .   .   .   133   .   N   .   133   .   HN   parsed_4uzx   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -23.730   .   .   .   .   .   134   .   N   .   134   .   HN   parsed_4uzx   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -22.600   .   .   .   .   .   135   .   N   .   135   .   HN   parsed_4uzx   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.840   .   .   .   .   .   136   .   N   .   136   .   HN   parsed_4uzx   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.940   .   .   .   .   .   137   .   N   .   137   .   HN   parsed_4uzx   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -25.810   .   .   .   .   .   138   .   N   .   138   .   HN   parsed_4uzx   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.530   .   .   .   .   .   139   .   N   .   139   .   HN   parsed_4uzx   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.530   .   .   .   .   .   140   .   N   .   140   .   HN   parsed_4uzx   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -19.380   .   .   .   .   .   141   .   N   .   141   .   HN   parsed_4uzx   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.550   .   .   .   .   .   143   .   N   .   143   .   HN   parsed_4uzx   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.840   .   .   .   .   .   145   .   N   .   145   .   HN   parsed_4uzx   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.360   .   .   .   .   .   146   .   N   .   146   .   HN   parsed_4uzx   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -19.980   .   .   .   .   .   147   .   N   .   147   .   HN   parsed_4uzx   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.630   .   .   .   .   .   148   .   N   .   148   .   HN   parsed_4uzx   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -21.910   .   .   .   .   .   150   .   N   .   150   .   HN   parsed_4uzx   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.840   .   .   .   .   .   151   .   N   .   151   .   HN   parsed_4uzx   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.160   .   .   .   .   .   152   .   N   .   152   .   HN   parsed_4uzx   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -13.100   .   .   .   .   .   153   .   N   .   153   .   HN   parsed_4uzx   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -20.310   .   .   .   .   .   154   .   N   .   154   .   HN   parsed_4uzx   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.110   .   .   .   .   .   155   .   N   .   155   .   HN   parsed_4uzx   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.400   .   .   .   .   .   156   .   N   .   156   .   HN   parsed_4uzx   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -18.850   .   .   .   .   .   157   .   N   .   157   .   HN   parsed_4uzx   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -17.910   .   .   .   .   .   158   .   N   .   158   .   HN   parsed_4uzx   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.210   .   .   .   .   .   159   .   N   .   159   .   HN   parsed_4uzx   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -21.780   .   .   .   .   .   161   .   N   .   161   .   HN   parsed_4uzx   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.090   .   .   .   .   .   162   .   N   .   162   .   HN   parsed_4uzx   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.040   .   .   .   .   .   163   .   N   .   163   .   HN   parsed_4uzx   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -19.140   .   .   .   .   .   166   .   N   .   166   .   HN   parsed_4uzx   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.980   .   .   .   .   .   167   .   N   .   167   .   HN   parsed_4uzx   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.260   .   .   .   .   .   168   .   N   .   168   .   HN   parsed_4uzx   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.450   .   .   .   .   .   169   .   N   .   169   .   HN   parsed_4uzx   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.550   .   .   .   .   .   170   .   N   .   170   .   HN   parsed_4uzx   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    17.350   .   .   .   .   .   172   .   N   .   172   .   HN   parsed_4uzx   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.810   .   .   .   .   .   173   .   N   .   173   .   HN   parsed_4uzx   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.260   .   .   .   .   .   174   .   N   .   174   .   HN   parsed_4uzx   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    19.510   .   .   .   .   .   175   .   N   .   175   .   HN   parsed_4uzx   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.970   .   .   .   .   .   177   .   N   .   177   .   HN   parsed_4uzx   1   
    stop_

save_





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