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 subtype subsubtype item_count
47764 2hgh 7194 cing 2-parsed STAR distance general distance simple 24


data_2hgh_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2hgh 
    _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_2hgh   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2hgh 
    _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   2hgh   "Master copy"    parsed_2hgh   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2hgh 
    _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   2hgh.mr   .   .   "MR format"     1    comment                  "Not applicable"      "Not applicable"      0   parsed_2hgh   1   
        1   2hgh.mr   .   .    DYANA/DIANA    2    distance                 "hydrogen bond"        simple             116   parsed_2hgh   1   
        1   2hgh.mr   .   .    DYANA/DIANA    3    distance                 "general distance"     simple              24   parsed_2hgh   1   
        1   2hgh.mr   .   .    DYANA/DIANA    4    distance                  NOE                   simple               0   parsed_2hgh   1   
        1   2hgh.mr   .   .    DYANA/DIANA    5    distance                  NOE                   simple               0   parsed_2hgh   1   
        1   2hgh.mr   .   .    DYANA/DIANA    6    distance                 "general distance"     simple               0   parsed_2hgh   1   
        1   2hgh.mr   .   .    DYANA/DIANA    7    distance                  NOE                   simple               0   parsed_2hgh   1   
        1   2hgh.mr   .   .    DYANA/DIANA    8    distance                 "general distance"     simple               0   parsed_2hgh   1   
        1   2hgh.mr   .   .    DYANA/DIANA    9    distance                  NOE                   simple               0   parsed_2hgh   1   
        1   2hgh.mr   .   .    DYANA/DIANA   10    distance                 "general distance"     simple               0   parsed_2hgh   1   
        1   2hgh.mr   .   .    DYANA/DIANA   11   "dihedral angle"          "Not applicable"      "Not applicable"      0   parsed_2hgh   1   
        1   2hgh.mr   .   .    NMRPipe       12   "coupling constant"       "Not applicable"      "Not applicable"      0   parsed_2hgh   1   
        1   2hgh.mr   .   .   "MR format"    13   "nomenclature mapping"    "Not applicable"      "Not applicable"      0   parsed_2hgh   1   
    stop_

save_


save_DYANA/DIANA_distance_constraints_3
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2hgh 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type    "general distance" 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            3 
    _Distance_constraint_list.Details            "Generated by Wattos" 

    loop_
        _Dist_constraint_tree.Constraint_ID 
        _Dist_constraint_tree.Node_ID 
        _Dist_constraint_tree.Down_node_ID 
        _Dist_constraint_tree.Right_node_ID 
        _Dist_constraint_tree.Logic_operation 
        _Dist_constraint_tree.Entry_ID 
        _Dist_constraint_tree.Distance_constraint_list_ID 

         1   1   .   .   .   parsed_2hgh   1   
         2   1   .   .   .   parsed_2hgh   1   
         3   1   .   .   .   parsed_2hgh   1   
         4   1   .   .   .   parsed_2hgh   1   
         5   1   .   .   .   parsed_2hgh   1   
         6   1   .   .   .   parsed_2hgh   1   
         7   1   .   .   .   parsed_2hgh   1   
         8   1   .   .   .   parsed_2hgh   1   
         9   1   .   .   .   parsed_2hgh   1   
        10   1   .   .   .   parsed_2hgh   1   
        11   1   .   .   .   parsed_2hgh   1   
        12   1   .   .   .   parsed_2hgh   1   
        13   1   .   .   .   parsed_2hgh   1   
        14   1   .   .   .   parsed_2hgh   1   
        15   1   .   .   .   parsed_2hgh   1   
        16   1   .   .   .   parsed_2hgh   1   
        17   1   .   .   .   parsed_2hgh   1   
        18   1   .   .   .   parsed_2hgh   1   
        19   1   .   .   .   parsed_2hgh   1   
        20   1   .   .   .   parsed_2hgh   1   
        21   1   .   .   .   parsed_2hgh   1   
        22   1   .   .   .   parsed_2hgh   1   
        23   1   .   .   .   parsed_2hgh   1   
        24   1   .   .   .   parsed_2hgh   1   
    stop_


    loop_
        _Dist_constraint.Tree_node_member_constraint_ID 
        _Dist_constraint.Tree_node_member_node_ID 
        _Dist_constraint.Constraint_tree_node_member_ID 
        _Dist_constraint.Assembly_atom_ID 
        _Dist_constraint.Entity_assembly_ID 
        _Dist_constraint.Entity_ID 
        _Dist_constraint.Comp_index_ID 
        _Dist_constraint.Seq_ID 
        _Dist_constraint.Comp_ID 
        _Dist_constraint.Atom_ID 
        _Dist_constraint.Resonance_ID 
        _Dist_constraint.Auth_asym_ID 
        _Dist_constraint.Auth_seq_ID 
        _Dist_constraint.Auth_comp_ID 
        _Dist_constraint.Auth_atom_ID 
        _Dist_constraint.Entry_ID 
        _Dist_constraint.Distance_constraint_list_ID 

         1   1   1   .   .   .   .   .   .   .   .   .    1   RGUA   C1'   parsed_2hgh   1   
         1   1   2   .   .   .   .   .   .   .   .   .   55   RCYT   C1'   parsed_2hgh   1   
         2   1   1   .   .   .   .   .   .   .   .   .    2   RGUA   C1'   parsed_2hgh   1   
         2   1   2   .   .   .   .   .   .   .   .   .   54   RCYT   C1'   parsed_2hgh   1   
         3   1   1   .   .   .   .   .   .   .   .   .    3   RGUA   C1'   parsed_2hgh   1   
         3   1   2   .   .   .   .   .   .   .   .   .   53   RCYT   C1'   parsed_2hgh   1   
         4   1   1   .   .   .   .   .   .   .   .   .    4   RCYT   C1'   parsed_2hgh   1   
         4   1   2   .   .   .   .   .   .   .   .   .   52   RGUA   C1'   parsed_2hgh   1   
         5   1   1   .   .   .   .   .   .   .   .   .    9   RCYT   C1'   parsed_2hgh   1   
         5   1   2   .   .   .   .   .   .   .   .   .   16   RGUA   C1'   parsed_2hgh   1   
         6   1   1   .   .   .   .   .   .   .   .   .   10   RCYT   C1'   parsed_2hgh   1   
         6   1   2   .   .   .   .   .   .   .   .   .   15   RGUA   C1'   parsed_2hgh   1   
         7   1   1   .   .   .   .   .   .   .   .   .   17   RGUA   C1'   parsed_2hgh   1   
         7   1   2   .   .   .   .   .   .   .   .   .   51   URA    C1'   parsed_2hgh   1   
         8   1   1   .   .   .   .   .   .   .   .   .   18   RCYT   C1'   parsed_2hgh   1   
         8   1   2   .   .   .   .   .   .   .   .   .   50   RGUA   C1'   parsed_2hgh   1   
         9   1   1   .   .   .   .   .   .   .   .   .   19   RCYT   C1'   parsed_2hgh   1   
         9   1   2   .   .   .   .   .   .   .   .   .   49   RGUA   C1'   parsed_2hgh   1   
        10   1   1   .   .   .   .   .   .   .   .   .   20   URA    C1'   parsed_2hgh   1   
        10   1   2   .   .   .   .   .   .   .   .   .   48   RADE   C1'   parsed_2hgh   1   
        11   1   1   .   .   .   .   .   .   .   .   .   21   RGUA   C1'   parsed_2hgh   1   
        11   1   2   .   .   .   .   .   .   .   .   .   47   RCYT   C1'   parsed_2hgh   1   
        12   1   1   .   .   .   .   .   .   .   .   .   22   RGUA   C1'   parsed_2hgh   1   
        12   1   2   .   .   .   .   .   .   .   .   .   46   RCYT   C1'   parsed_2hgh   1   
        13   1   1   .   .   .   .   .   .   .   .   .   23   URA    C1'   parsed_2hgh   1   
        13   1   2   .   .   .   .   .   .   .   .   .   45   RADE   C1'   parsed_2hgh   1   
        14   1   1   .   .   .   .   .   .   .   .   .   24   URA    C1'   parsed_2hgh   1   
        14   1   2   .   .   .   .   .   .   .   .   .   44   URA    C1'   parsed_2hgh   1   
        15   1   1   .   .   .   .   .   .   .   .   .   24   URA    N3    parsed_2hgh   1   
        15   1   2   .   .   .   .   .   .   .   .   .   44   URA    N3    parsed_2hgh   1   
        16   1   1   .   .   .   .   .   .   .   .   .   25   RADE   C1'   parsed_2hgh   1   
        16   1   2   .   .   .   .   .   .   .   .   .   43   RADE   C1'   parsed_2hgh   1   
        17   1   1   .   .   .   .   .   .   .   .   .   27   URA    C1'   parsed_2hgh   1   
        17   1   2   .   .   .   .   .   .   .   .   .   42   RADE   C1'   parsed_2hgh   1   
        18   1   1   .   .   .   .   .   .   .   .   .   28   RADE   C1'   parsed_2hgh   1   
        18   1   2   .   .   .   .   .   .   .   .   .   41   RGUA   C1'   parsed_2hgh   1   
        19   1   1   .   .   .   .   .   .   .   .   .   29   RCYT   C1'   parsed_2hgh   1   
        19   1   2   .   .   .   .   .   .   .   .   .   40   RGUA   C1'   parsed_2hgh   1   
        20   1   1   .   .   .   .   .   .   .   .   .   30   RCYT   C1'   parsed_2hgh   1   
        20   1   2   .   .   .   .   .   .   .   .   .   39   RGUA   C1'   parsed_2hgh   1   
        21   1   1   .   .   .   .   .   .   .   .   .   31   URA    C1'   parsed_2hgh   1   
        21   1   2   .   .   .   .   .   .   .   .   .   38   URA    C1'   parsed_2hgh   1   
        22   1   1   .   .   .   .   .   .   .   .   .   31   URA    N3    parsed_2hgh   1   
        22   1   2   .   .   .   .   .   .   .   .   .   38   URA    N3    parsed_2hgh   1   
        23   1   1   .   .   .   .   .   .   .   .   .   32   RCYT   C1'   parsed_2hgh   1   
        23   1   2   .   .   .   .   .   .   .   .   .   37   RGUA   C1'   parsed_2hgh   1   
        24   1   1   .   .   .   .   .   .   .   .   .   33   URA    C1'   parsed_2hgh   1   
        24   1   2   .   .   .   .   .   .   .   .   .   36   RGUA   C1'   parsed_2hgh   1   
    stop_


    loop_
        _Dist_constraint_value.Constraint_ID 
        _Dist_constraint_value.Tree_node_ID 
        _Dist_constraint_value.Source_experiment_ID 
        _Dist_constraint_value.Spectral_peak_ID 
        _Dist_constraint_value.Intensity_val 
        _Dist_constraint_value.Intensity_lower_val_err 
        _Dist_constraint_value.Intensity_upper_val_err 
        _Dist_constraint_value.Distance_val 
        _Dist_constraint_value.Distance_lower_bound_val 
        _Dist_constraint_value.Distance_upper_bound_val 
        _Dist_constraint_value.Entry_ID 
        _Dist_constraint_value.Distance_constraint_list_ID 

         1   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
         2   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
         3   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
         4   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
         5   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
         6   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
         7   1   .   .   .   .   .   .   .   12.00   parsed_2hgh   1   
         8   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
         9   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
        10   1   .   .   .   .   .   .   .   10.50   parsed_2hgh   1   
        11   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
        12   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
        13   1   .   .   .   .   .   .   .   10.50   parsed_2hgh   1   
        14   1   .   .   .   .   .   .   .    9.20   parsed_2hgh   1   
        15   1   .   .   .   .   .   .   .    3.70   parsed_2hgh   1   
        16   1   .   .   .   .   .   .   .   11.20   parsed_2hgh   1   
        17   1   .   .   .   .   .   .   .    9.90   parsed_2hgh   1   
        18   1   .   .   .   .   .   .   .    9.70   parsed_2hgh   1   
        19   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
        20   1   .   .   .   .   .   .   .   10.80   parsed_2hgh   1   
        21   1   .   .   .   .   .   .   .    9.20   parsed_2hgh   1   
        22   1   .   .   .   .   .   .   .    3.70   parsed_2hgh   1   
        23   1   .   .   .   .   .   .   .   10.40   parsed_2hgh   1   
        24   1   .   .   .   .   .   .   .   10.10   parsed_2hgh   1   
    stop_


    loop_
        _Dist_constraint_comment_org.ID 
        _Dist_constraint_comment_org.Comment_text 
        _Dist_constraint_comment_org.Comment_begin_line 
        _Dist_constraint_comment_org.Comment_begin_column 
        _Dist_constraint_comment_org.Comment_end_line 
        _Dist_constraint_comment_org.Comment_end_column 
        _Dist_constraint_comment_org.Entry_ID 
        _Dist_constraint_comment_org.Distance_constraint_list_ID 

         1    ****************************************            1    1    1   41   parsed_2hgh   1   
         2    --Planarity--Base-Pairs                             2    1    2   24   parsed_2hgh   1   
         3    ****************************************            3    1    3   41   parsed_2hgh   1   
         4   "removed 23jul02"                                   17   38   17   53   parsed_2hgh   1   
         5   "430D 11.0"                                         19   38   19   47   parsed_2hgh   1   
         6   "26 RGUA C1'    27 URA C1'      7.10 #430D 6.88"    20    1   20   47   parsed_2hgh   1   
         7   "26 RGUA C1'    42 RADE C1'    10.60 #430D 10.4"    21    1   21   47   parsed_2hgh   1   
         8   "430D 9.7"                                          22   38   22   46   parsed_2hgh   1   
         9   "430D 9.5"                                          23   38   23   46   parsed_2hgh   1   
        10   "removed 23jul02"                                   26   38   26   53   parsed_2hgh   1   
        11    ****************************************           30    1   30   41   parsed_2hgh   1   
        12    --NOE--Base-Pairs                                  31    1   31   18   parsed_2hgh   1   
        13    ****************************************           32    1   32   41   parsed_2hgh   1   
    stop_

save_





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