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
595284 2n29 25592 cing 2-parsed STAR dipolar coupling 39


data_2n29_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2n29 
    _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_2n29   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2n29 
    _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   2n29   "Master copy"    parsed_2n29   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2n29 
    _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   2n29.mr   .   .   "MR format"    1    comment                  "Not applicable"      "Not applicable"     0   parsed_2n29   1   
        1   2n29.mr   .   .    XPLOR/CNS     2   "dihedral angle"          "Not applicable"      "Not applicable"    62   parsed_2n29   1   
        1   2n29.mr   .   .    XPLOR/CNS     3   "dipolar coupling"        "Not applicable"      "Not applicable"    39   parsed_2n29   1   
        1   2n29.mr   .   .    XPLOR/CNS     4    distance                  NOE                   ambi                0   parsed_2n29   1   
        1   2n29.mr   .   .    XPLOR/CNS     5    distance                 "general distance"     simple              0   parsed_2n29   1   
        1   2n29.mr   .   .   "MR format"    6   "nomenclature mapping"    "Not applicable"      "Not applicable"     0   parsed_2n29   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_3
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_2n29 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            3 
    _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   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.4614   .   .   .   .   .    3   .   N   .    3   .   HN   parsed_2n29   1   
         2   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    1.5111   .   .   .   .   .    4   .   N   .    4   .   HN   parsed_2n29   1   
         3   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -0.4662   .   .   .   .   .    5   .   N   .    5   .   HN   parsed_2n29   1   
         4   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -0.2016   .   .   .   .   .    6   .   N   .    6   .   HN   parsed_2n29   1   
         5   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    1.8128   .   .   .   .   .    7   .   N   .    7   .   HN   parsed_2n29   1   
         6   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.2660   .   .   .   .   .    8   .   N   .    8   .   HN   parsed_2n29   1   
         7   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    3.4228   .   .   .   .   .    9   .   N   .    9   .   HN   parsed_2n29   1   
         8   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    4.0832   .   .   .   .   .   10   .   N   .   10   .   HN   parsed_2n29   1   
         9   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.8639   .   .   .   .   .   13   .   N   .   13   .   HN   parsed_2n29   1   
        10   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    9.0925   .   .   .   .   .   17   .   N   .   17   .   HN   parsed_2n29   1   
        11   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.1931   .   .   .   .   .   18   .   N   .   18   .   HN   parsed_2n29   1   
        12   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    1.2384   .   .   .   .   .   20   .   N   .   20   .   HN   parsed_2n29   1   
        13   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    9.0251   .   .   .   .   .   21   .   N   .   21   .   HN   parsed_2n29   1   
        14   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    3.4741   .   .   .   .   .   22   .   N   .   22   .   HN   parsed_2n29   1   
        15   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.5072   .   .   .   .   .   23   .   N   .   23   .   HN   parsed_2n29   1   
        16   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    3.9935   .   .   .   .   .   25   .   N   .   25   .   HN   parsed_2n29   1   
        17   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    0.6511   .   .   .   .   .   26   .   N   .   26   .   HN   parsed_2n29   1   
        18   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.0379   .   .   .   .   .   28   .   N   .   28   .   HN   parsed_2n29   1   
        19   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -1.5371   .   .   .   .   .   29   .   N   .   29   .   HN   parsed_2n29   1   
        20   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    4.1227   .   .   .   .   .   30   .   N   .   30   .   HN   parsed_2n29   1   
        21   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    7.6581   .   .   .   .   .   31   .   N   .   31   .   HN   parsed_2n29   1   
        22   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    8.4965   .   .   .   .   .   32   .   N   .   32   .   HN   parsed_2n29   1   
        23   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    5.0446   .   .   .   .   .   33   .   N   .   33   .   HN   parsed_2n29   1   
        24   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   11.2596   .   .   .   .   .   34   .   N   .   34   .   HN   parsed_2n29   1   
        25   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   14.1853   .   .   .   .   .   35   .   N   .   35   .   HN   parsed_2n29   1   
        26   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.8800   .   .   .   .   .   36   .   N   .   36   .   HN   parsed_2n29   1   
        27   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   18.6005   .   .   .   .   .   39   .   N   .   39   .   HN   parsed_2n29   1   
        28   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    7.0955   .   .   .   .   .   40   .   N   .   40   .   HN   parsed_2n29   1   
        29   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   16.5905   .   .   .   .   .   41   .   N   .   41   .   HN   parsed_2n29   1   
        30   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    5.4978   .   .   .   .   .   43   .   N   .   43   .   HN   parsed_2n29   1   
        31   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    5.0607   .   .   .   .   .   44   .   N   .   44   .   HN   parsed_2n29   1   
        32   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -2.6611   .   .   .   .   .   45   .   N   .   45   .   HN   parsed_2n29   1   
        33   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    8.5911   .   .   .   .   .   46   .   N   .   46   .   HN   parsed_2n29   1   
        34   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.7174   .   .   .   .   .   47   .   N   .   47   .   HN   parsed_2n29   1   
        35   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    1.8586   .   .   .   .   .   49   .   N   .   49   .   HN   parsed_2n29   1   
        36   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    2.1931   .   .   .   .   .   50   .   N   .   50   .   HN   parsed_2n29   1   
        37   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -0.4019   .   .   .   .   .   51   .   N   .   51   .   HN   parsed_2n29   1   
        38   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   -0.0272   .   .   .   .   .   52   .   N   .   52   .   HN   parsed_2n29   1   
        39   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .   .    1.9012   .   .   .   .   .   54   .   N   .   54   .   HN   parsed_2n29   1   
    stop_

save_





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