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
531582 2l9j 17451 cing 2-parsed STAR dipolar coupling 44


data_2l9j_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2l9j 
    _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_2l9j   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2l9j 
    _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   2l9j   "Master copy"    parsed_2l9j   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2l9j 
    _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   2l9j.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_2l9j   1   
        1   2l9j.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             1539   parsed_2l9j   1   
        1   2l9j.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"     151   parsed_2l9j   1   
        1   2l9j.mr   .   .    XPLOR/CNS     4   "dipolar coupling"        "Not applicable"    "Not applicable"      56   parsed_2l9j   1   
        1   2l9j.mr   .   .    XPLOR/CNS     5   "dipolar coupling"        "Not applicable"    "Not applicable"      44   parsed_2l9j   1   
        1   2l9j.mr   .   .   "MR format"    6   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_2l9j   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_5
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_2l9j 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            5 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.700   .   .   .   .   .    76   .   N   .    76   .   HN   parsed_2l9j   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.200   .   .   .   .   .    77   .   N   .    77   .   HN   parsed_2l9j   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.700   .   .   .   .   .    79   .   N   .    79   .   HN   parsed_2l9j   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.900   .   .   .   .   .    80   .   N   .    80   .   HN   parsed_2l9j   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.600   .   .   .   .   .    81   .   N   .    81   .   HN   parsed_2l9j   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.900   .   .   .   .   .    83   .   N   .    83   .   HN   parsed_2l9j   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.100   .   .   .   .   .    84   .   N   .    84   .   HN   parsed_2l9j   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.000   .   .   .   .   .    92   .   N   .    92   .   HN   parsed_2l9j   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.000   .   .   .   .   .    93   .   N   .    93   .   HN   parsed_2l9j   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.000   .   .   .   .   .    98   .   N   .    98   .   HN   parsed_2l9j   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.800   .   .   .   .   .   101   .   N   .   101   .   HN   parsed_2l9j   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.300   .   .   .   .   .   102   .   N   .   102   .   HN   parsed_2l9j   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.300   .   .   .   .   .   103   .   N   .   103   .   HN   parsed_2l9j   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.900   .   .   .   .   .   108   .   N   .   108   .   HN   parsed_2l9j   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.200   .   .   .   .   .   109   .   N   .   109   .   HN   parsed_2l9j   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.100   .   .   .   .   .   111   .   N   .   111   .   HN   parsed_2l9j   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.400   .   .   .   .   .   112   .   N   .   112   .   HN   parsed_2l9j   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.600   .   .   .   .   .   113   .   N   .   113   .   HN   parsed_2l9j   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -6.300   .   .   .   .   .   116   .   N   .   116   .   HN   parsed_2l9j   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.500   .   .   .   .   .   124   .   N   .   124   .   HN   parsed_2l9j   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.900   .   .   .   .   .   125   .   N   .   125   .   HN   parsed_2l9j   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.700   .   .   .   .   .   127   .   N   .   127   .   HN   parsed_2l9j   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.500   .   .   .   .   .   128   .   N   .   128   .   HN   parsed_2l9j   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.600   .   .   .   .   .   129   .   N   .   129   .   HN   parsed_2l9j   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.500   .   .   .   .   .   131   .   N   .   131   .   HN   parsed_2l9j   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.700   .   .   .   .   .   132   .   N   .   132   .   HN   parsed_2l9j   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.700   .   .   .   .   .   135   .   N   .   135   .   HN   parsed_2l9j   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.700   .   .   .   .   .   136   .   N   .   136   .   HN   parsed_2l9j   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.600   .   .   .   .   .   137   .   N   .   137   .   HN   parsed_2l9j   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.900   .   .   .   .   .   138   .   N   .   138   .   HN   parsed_2l9j   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.200   .   .   .   .   .   140   .   N   .   140   .   HN   parsed_2l9j   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.600   .   .   .   .   .   144   .   N   .   144   .   HN   parsed_2l9j   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.700   .   .   .   .   .   151   .   N   .   151   .   HN   parsed_2l9j   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.600   .   .   .   .   .   155   .   N   .   155   .   HN   parsed_2l9j   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.300   .   .   .   .   .   156   .   N   .   156   .   HN   parsed_2l9j   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.500   .   .   .   .   .   157   .   N   .   157   .   HN   parsed_2l9j   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.800   .   .   .   .   .   158   .   N   .   158   .   HN   parsed_2l9j   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.600   .   .   .   .   .   160   .   N   .   160   .   HN   parsed_2l9j   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.600   .   .   .   .   .   161   .   N   .   161   .   HN   parsed_2l9j   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.500   .   .   .   .   .   163   .   N   .   163   .   HN   parsed_2l9j   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.800   .   .   .   .   .   165   .   N   .   165   .   HN   parsed_2l9j   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.600   .   .   .   .   .   166   .   N   .   166   .   HN   parsed_2l9j   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.600   .   .   .   .   .   168   .   N   .   168   .   HN   parsed_2l9j   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.300   .   .   .   .   .   169   .   N   .   169   .   HN   parsed_2l9j   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   "# -3.6"    237   52   237   57   parsed_2l9j   1   
    stop_

save_





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