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
49994 2jxn 15562 cing 2-parsed STAR dipolar coupling 28


data_2jxn_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2jxn 
    _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_2jxn   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2jxn 
    _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   2jxn   "Master copy"    parsed_2jxn   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2jxn 
    _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   2jxn.mr   .   .   "MR format"    1    comment                  "Not applicable"      "Not applicable"       0   parsed_2jxn   1   
        1   2jxn.mr   .   .    XPLOR/CNS     2    distance                  NOE                   simple             1483   parsed_2jxn   1   
        1   2jxn.mr   .   .    XPLOR/CNS     3    distance                 "general distance"     simple              142   parsed_2jxn   1   
        1   2jxn.mr   .   .    XPLOR/CNS     4    distance                 "hydrogen bond"        simple               58   parsed_2jxn   1   
        1   2jxn.mr   .   .    XPLOR/CNS     5   "dihedral angle"          "Not applicable"      "Not applicable"     107   parsed_2jxn   1   
        1   2jxn.mr   .   .    XPLOR/CNS     6   "coupling constant"       "Not applicable"      "Not applicable"       0   parsed_2jxn   1   
        1   2jxn.mr   .   .    XPLOR/CNS     7   "dipolar coupling"        "Not applicable"      "Not applicable"      28   parsed_2jxn   1   
        1   2jxn.mr   .   .   "MR format"    8   "nomenclature mapping"    "Not applicable"      "Not applicable"       0   parsed_2jxn   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_7
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_2jxn 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.72   .   .   .   .   .     4   .   N   .     4   .   HN   parsed_2jxn   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.72   .   .   .   .   .     8   .   N   .     8   .   HN   parsed_2jxn   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.17   .   .   .   .   .     9   .   N   .     9   .   HN   parsed_2jxn   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -13.77   .   .   .   .   .    10   .   N   .    10   .   HN   parsed_2jxn   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -16.64   .   .   .   .   .    11   .   N   .    11   .   HN   parsed_2jxn   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.88   .   .   .   .   .    12   .   N   .    12   .   HN   parsed_2jxn   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -14.20   .   .   .   .   .    14   .   N   .    14   .   HN   parsed_2jxn   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -11.85   .   .   .   .   .    15   .   N   .    15   .   HN   parsed_2jxn   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    15.07   .   .   .   .   .    42   .   N   .    42   .   HN   parsed_2jxn   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.32   .   .   .   .   .    43   .   N   .    43   .   HN   parsed_2jxn   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -13.39   .   .   .   .   .    50   .   N   .    50   .   HN   parsed_2jxn   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -15.92   .   .   .   .   .    51   .   N   .    51   .   HN   parsed_2jxn   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     0.11   .   .   .   .   .    54   .   N   .    54   .   HN   parsed_2jxn   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     1.00   .   .   .   .   .    61   .   N   .    61   .   HN   parsed_2jxn   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -5.25   .   .   .   .   .    62   .   N   .    62   .   HN   parsed_2jxn   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -3.5    .   .   .   .   .    63   .   N   .    63   .   HN   parsed_2jxn   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -0.10   .   .   .   .   .    64   .   N   .    64   .   HN   parsed_2jxn   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.10   .   .   .   .   .    65   .   N   .    65   .   HN   parsed_2jxn   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    11.88   .   .   .   .   .    67   .   N   .    67   .   HN   parsed_2jxn   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     4.61   .   .   .   .   .    69   .   N   .    69   .   HN   parsed_2jxn   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    14.71   .   .   .   .   .    71   .   N   .    71   .   HN   parsed_2jxn   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     9.01   .   .   .   .   .    74   .   N   .    74   .   HN   parsed_2jxn   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    14.84   .   .   .   .   .    79   .   N   .    79   .   HN   parsed_2jxn   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .     3.87   .   .   .   .   .    85   .   N   .    85   .   HN   parsed_2jxn   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.91   .   .   .   .   .    91   .   N   .    91   .   HN   parsed_2jxn   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    -7.48   .   .   .   .   .    95   .   N   .    95   .   HN   parsed_2jxn   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -10.82   .   .   .   .   .    98   .   N   .    98   .   HN   parsed_2jxn   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -12.50   .   .   .   .   .   100   .   N   .   100   .   HN   parsed_2jxn   1   
    stop_

save_





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