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
585232 2muk 25217 cing 2-parsed STAR dipolar coupling 51


data_2muk_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2muk 
    _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_2muk   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2muk 
    _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   2muk   "Master copy"    parsed_2muk   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2muk 
    _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   2muk.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_2muk   1   
        1   2muk.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             1857   parsed_2muk   1   
        1   2muk.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"     183   parsed_2muk   1   
        1   2muk.mr   .   .    XPLOR/CNS     4   "dipolar coupling"        "Not applicable"    "Not applicable"      51   parsed_2muk   1   
        1   2muk.mr   .   .    XPLOR/CNS     5    distance                 "hydrogen bond"      simple                0   parsed_2muk   1   
        1   2muk.mr   .   .   "MR format"    6   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_2muk   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_4
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_2muk 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5200   .   .   .   .   .   112   .   N   .   112   .   HN   parsed_2muk   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     7.0400   .   .   .   .   .   113   .   N   .   113   .   HN   parsed_2muk   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.5400   .   .   .   .   .   114   .   N   .   114   .   HN   parsed_2muk   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.7200   .   .   .   .   .   115   .   N   .   115   .   HN   parsed_2muk   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.1400   .   .   .   .   .   116   .   N   .   116   .   HN   parsed_2muk   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.2000   .   .   .   .   .   117   .   N   .   117   .   HN   parsed_2muk   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.1100   .   .   .   .   .   118   .   N   .   118   .   HN   parsed_2muk   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.0900   .   .   .   .   .   123   .   N   .   123   .   HN   parsed_2muk   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.8900   .   .   .   .   .   124   .   N   .   124   .   HN   parsed_2muk   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.7000   .   .   .   .   .   125   .   N   .   125   .   HN   parsed_2muk   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     5.7700   .   .   .   .   .   126   .   N   .   126   .   HN   parsed_2muk   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.4300   .   .   .   .   .   127   .   N   .   127   .   HN   parsed_2muk   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    10.8300   .   .   .   .   .   128   .   N   .   128   .   HN   parsed_2muk   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.1300   .   .   .   .   .   133   .   N   .   133   .   HN   parsed_2muk   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -2.5400   .   .   .   .   .   134   .   N   .   134   .   HN   parsed_2muk   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -13.1600   .   .   .   .   .   136   .   N   .   136   .   HN   parsed_2muk   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.7300   .   .   .   .   .   137   .   N   .   137   .   HN   parsed_2muk   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.1300   .   .   .   .   .   138   .   N   .   138   .   HN   parsed_2muk   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -8.5600   .   .   .   .   .   139   .   N   .   139   .   HN   parsed_2muk   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -9.5900   .   .   .   .   .   140   .   N   .   140   .   HN   parsed_2muk   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.2100   .   .   .   .   .   141   .   N   .   141   .   HN   parsed_2muk   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.1900   .   .   .   .   .   142   .   N   .   142   .   HN   parsed_2muk   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.3100   .   .   .   .   .   143   .   N   .   143   .   HN   parsed_2muk   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.2800   .   .   .   .   .   144   .   N   .   144   .   HN   parsed_2muk   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     6.0800   .   .   .   .   .   145   .   N   .   145   .   HN   parsed_2muk   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.1000   .   .   .   .   .   163   .   N   .   163   .   HN   parsed_2muk   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.5500   .   .   .   .   .   164   .   N   .   164   .   HN   parsed_2muk   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.1000   .   .   .   .   .   166   .   N   .   166   .   HN   parsed_2muk   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.0700   .   .   .   .   .   167   .   N   .   167   .   HN   parsed_2muk   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.1200   .   .   .   .   .   168   .   N   .   168   .   HN   parsed_2muk   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.3000   .   .   .   .   .   169   .   N   .   169   .   HN   parsed_2muk   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.1500   .   .   .   .   .   170   .   N   .   170   .   HN   parsed_2muk   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.5500   .   .   .   .   .   172   .   N   .   172   .   HN   parsed_2muk   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.4500   .   .   .   .   .   173   .   N   .   173   .   HN   parsed_2muk   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -4.0600   .   .   .   .   .   176   .   N   .   176   .   HN   parsed_2muk   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.2100   .   .   .   .   .   178   .   N   .   178   .   HN   parsed_2muk   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.7500   .   .   .   .   .   180   .   N   .   180   .   HN   parsed_2muk   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.0600   .   .   .   .   .   181   .   N   .   181   .   HN   parsed_2muk   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.1400   .   .   .   .   .   182   .   N   .   182   .   HN   parsed_2muk   1   
        40   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.7600   .   .   .   .   .   183   .   N   .   183   .   HN   parsed_2muk   1   
        41   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.4600   .   .   .   .   .   187   .   N   .   187   .   HN   parsed_2muk   1   
        42   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.1400   .   .   .   .   .   189   .   N   .   189   .   HN   parsed_2muk   1   
        43   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     2.9900   .   .   .   .   .   190   .   N   .   190   .   HN   parsed_2muk   1   
        44   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.1500   .   .   .   .   .   191   .   N   .   191   .   HN   parsed_2muk   1   
        45   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -1.4100   .   .   .   .   .   194   .   N   .   194   .   HN   parsed_2muk   1   
        46   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.9100   .   .   .   .   .   196   .   N   .   196   .   HN   parsed_2muk   1   
        47   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    12.5900   .   .   .   .   .   200   .   N   .   200   .   HN   parsed_2muk   1   
        48   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.8300   .   .   .   .   .   201   .   N   .   201   .   HN   parsed_2muk   1   
        49   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     8.2200   .   .   .   .   .   202   .   N   .   202   .   HN   parsed_2muk   1   
        50   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.0800   .   .   .   .   .   206   .   N   .   206   .   HN   parsed_2muk   1   
        51   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.0200   .   .   .   .   .   207   .   N   .   207   .   HN   parsed_2muk   1   
    stop_

save_





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