BMRB

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
48091 2hwt RC 7112 cing 2-parsed STAR distance hydrogen bond simple 40


data_2hwt_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2hwt 
    _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_2hwt   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2hwt 
    _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   2hwt   "Master copy"    parsed_2hwt   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2hwt 
    _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   2hwt.mr   .   .   "MR format"    1    comment                  "Not applicable"      "Not applicable"       0   parsed_2hwt   1   
        1   2hwt.mr   .   .    DYANA/DIANA   2    distance                  NOE                   simple             1248   parsed_2hwt   1   
        1   2hwt.mr   .   .    DYANA/DIANA   3    distance                 "general distance"     simple                2   parsed_2hwt   1   
        1   2hwt.mr   .   .    DYANA/DIANA   4    distance                 "hydrogen bond"        simple               40   parsed_2hwt   1   
        1   2hwt.mr   .   .    DYANA/DIANA   5   "dihedral angle"          "Not applicable"      "Not applicable"       0   parsed_2hwt   1   
        1   2hwt.mr   .   .   "MR format"    6   "nomenclature mapping"    "Not applicable"      "Not applicable"       0   parsed_2hwt   1   
    stop_

save_


save_DYANA/DIANA_distance_constraints_4
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_2hwt 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type    "hydrogen bond" 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            4 
    _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_2hwt   1   
         2   1   .   .   .   parsed_2hwt   1   
         3   1   .   .   .   parsed_2hwt   1   
         4   1   .   .   .   parsed_2hwt   1   
         5   1   .   .   .   parsed_2hwt   1   
         6   1   .   .   .   parsed_2hwt   1   
         7   1   .   .   .   parsed_2hwt   1   
         8   1   .   .   .   parsed_2hwt   1   
         9   1   .   .   .   parsed_2hwt   1   
        10   1   .   .   .   parsed_2hwt   1   
        11   1   .   .   .   parsed_2hwt   1   
        12   1   .   .   .   parsed_2hwt   1   
        13   1   .   .   .   parsed_2hwt   1   
        14   1   .   .   .   parsed_2hwt   1   
        15   1   .   .   .   parsed_2hwt   1   
        16   1   .   .   .   parsed_2hwt   1   
        17   1   .   .   .   parsed_2hwt   1   
        18   1   .   .   .   parsed_2hwt   1   
        19   1   .   .   .   parsed_2hwt   1   
        20   1   .   .   .   parsed_2hwt   1   
        21   1   .   .   .   parsed_2hwt   1   
        22   1   .   .   .   parsed_2hwt   1   
        23   1   .   .   .   parsed_2hwt   1   
        24   1   .   .   .   parsed_2hwt   1   
        25   1   .   .   .   parsed_2hwt   1   
        26   1   .   .   .   parsed_2hwt   1   
        27   1   .   .   .   parsed_2hwt   1   
        28   1   .   .   .   parsed_2hwt   1   
        29   1   .   .   .   parsed_2hwt   1   
        30   1   .   .   .   parsed_2hwt   1   
        31   1   .   .   .   parsed_2hwt   1   
        32   1   .   .   .   parsed_2hwt   1   
        33   1   .   .   .   parsed_2hwt   1   
        34   1   .   .   .   parsed_2hwt   1   
        35   1   .   .   .   parsed_2hwt   1   
        36   1   .   .   .   parsed_2hwt   1   
        37   1   .   .   .   parsed_2hwt   1   
        38   1   .   .   .   parsed_2hwt   1   
        39   1   .   .   .   parsed_2hwt   1   
        40   1   .   .   .   parsed_2hwt   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   .   .   .   .   .   .   .   .   .    8   TRP   N   parsed_2hwt   1   
         1   1   2   .   .   .   .   .   .   .   .   .   46   ILE   O   parsed_2hwt   1   
         2   1   1   .   .   .   .   .   .   .   .   .    8   TRP   H   parsed_2hwt   1   
         2   1   2   .   .   .   .   .   .   .   .   .   46   ILE   O   parsed_2hwt   1   
         3   1   1   .   .   .   .   .   .   .   .   .    8   TRP   O   parsed_2hwt   1   
         3   1   2   .   .   .   .   .   .   .   .   .   46   ILE   N   parsed_2hwt   1   
         4   1   1   .   .   .   .   .   .   .   .   .    8   TRP   O   parsed_2hwt   1   
         4   1   2   .   .   .   .   .   .   .   .   .   46   ILE   H   parsed_2hwt   1   
         5   1   1   .   .   .   .   .   .   .   .   .   10   PHE   N   parsed_2hwt   1   
         5   1   2   .   .   .   .   .   .   .   .   .   44   GLY   O   parsed_2hwt   1   
         6   1   1   .   .   .   .   .   .   .   .   .   10   PHE   H   parsed_2hwt   1   
         6   1   2   .   .   .   .   .   .   .   .   .   44   GLY   O   parsed_2hwt   1   
         7   1   1   .   .   .   .   .   .   .   .   .   10   PHE   O   parsed_2hwt   1   
         7   1   2   .   .   .   .   .   .   .   .   .   44   GLY   N   parsed_2hwt   1   
         8   1   1   .   .   .   .   .   .   .   .   .   10   PHE   O   parsed_2hwt   1   
         8   1   2   .   .   .   .   .   .   .   .   .   44   GLY   H   parsed_2hwt   1   
         9   1   1   .   .   .   .   .   .   .   .   .   12   LEU   N   parsed_2hwt   1   
         9   1   2   .   .   .   .   .   .   .   .   .   42   PHE   O   parsed_2hwt   1   
        10   1   1   .   .   .   .   .   .   .   .   .   12   LEU   H   parsed_2hwt   1   
        10   1   2   .   .   .   .   .   .   .   .   .   42   PHE   O   parsed_2hwt   1   
        11   1   1   .   .   .   .   .   .   .   .   .   12   LEU   O   parsed_2hwt   1   
        11   1   2   .   .   .   .   .   .   .   .   .   42   PHE   N   parsed_2hwt   1   
        12   1   1   .   .   .   .   .   .   .   .   .   12   LEU   O   parsed_2hwt   1   
        12   1   2   .   .   .   .   .   .   .   .   .   42   PHE   H   parsed_2hwt   1   
        13   1   1   .   .   .   .   .   .   .   .   .    9   CYS   N   parsed_2hwt   1   
        13   1   2   .   .   .   .   .   .   .   .   .   67   GLU   O   parsed_2hwt   1   
        14   1   1   .   .   .   .   .   .   .   .   .    9   CYS   H   parsed_2hwt   1   
        14   1   2   .   .   .   .   .   .   .   .   .   67   GLU   O   parsed_2hwt   1   
        15   1   1   .   .   .   .   .   .   .   .   .    9   CYS   O   parsed_2hwt   1   
        15   1   2   .   .   .   .   .   .   .   .   .   67   GLU   N   parsed_2hwt   1   
        16   1   1   .   .   .   .   .   .   .   .   .    9   CYS   O   parsed_2hwt   1   
        16   1   2   .   .   .   .   .   .   .   .   .   67   GLU   H   parsed_2hwt   1   
        17   1   1   .   .   .   .   .   .   .   .   .   11   THR   N   parsed_2hwt   1   
        17   1   2   .   .   .   .   .   .   .   .   .   65   HIS   O   parsed_2hwt   1   
        18   1   1   .   .   .   .   .   .   .   .   .   11   THR   H   parsed_2hwt   1   
        18   1   2   .   .   .   .   .   .   .   .   .   65   HIS   O   parsed_2hwt   1   
        19   1   1   .   .   .   .   .   .   .   .   .   11   THR   O   parsed_2hwt   1   
        19   1   2   .   .   .   .   .   .   .   .   .   65   HIS   N   parsed_2hwt   1   
        20   1   1   .   .   .   .   .   .   .   .   .   11   THR   O   parsed_2hwt   1   
        20   1   2   .   .   .   .   .   .   .   .   .   65   HIS   H   parsed_2hwt   1   
        21   1   1   .   .   .   .   .   .   .   .   .   29   VAL   N   parsed_2hwt   1   
        21   1   2   .   .   .   .   .   .   .   .   .   45   TYR   O   parsed_2hwt   1   
        22   1   1   .   .   .   .   .   .   .   .   .   29   VAL   H   parsed_2hwt   1   
        22   1   2   .   .   .   .   .   .   .   .   .   45   TYR   O   parsed_2hwt   1   
        23   1   1   .   .   .   .   .   .   .   .   .   29   VAL   O   parsed_2hwt   1   
        23   1   2   .   .   .   .   .   .   .   .   .   45   TYR   N   parsed_2hwt   1   
        24   1   1   .   .   .   .   .   .   .   .   .   29   VAL   O   parsed_2hwt   1   
        24   1   2   .   .   .   .   .   .   .   .   .   45   TYR   H   parsed_2hwt   1   
        25   1   1   .   .   .   .   .   .   .   .   .   31   GLN   N   parsed_2hwt   1   
        25   1   2   .   .   .   .   .   .   .   .   .   43   GLN   O   parsed_2hwt   1   
        26   1   1   .   .   .   .   .   .   .   .   .   31   GLN   H   parsed_2hwt   1   
        26   1   2   .   .   .   .   .   .   .   .   .   43   GLN   O   parsed_2hwt   1   
        27   1   1   .   .   .   .   .   .   .   .   .   31   GLN   O   parsed_2hwt   1   
        27   1   2   .   .   .   .   .   .   .   .   .   43   GLN   N   parsed_2hwt   1   
        28   1   1   .   .   .   .   .   .   .   .   .   31   GLN   O   parsed_2hwt   1   
        28   1   2   .   .   .   .   .   .   .   .   .   43   GLN   H   parsed_2hwt   1   
        29   1   1   .   .   .   .   .   .   .   .   .   33   GLU   N   parsed_2hwt   1   
        29   1   2   .   .   .   .   .   .   .   .   .   41   HIS   O   parsed_2hwt   1   
        30   1   1   .   .   .   .   .   .   .   .   .   33   GLU   H   parsed_2hwt   1   
        30   1   2   .   .   .   .   .   .   .   .   .   41   HIS   O   parsed_2hwt   1   
        31   1   1   .   .   .   .   .   .   .   .   .   33   GLU   O   parsed_2hwt   1   
        31   1   2   .   .   .   .   .   .   .   .   .   41   HIS   N   parsed_2hwt   1   
        32   1   1   .   .   .   .   .   .   .   .   .   33   GLU   O   parsed_2hwt   1   
        32   1   2   .   .   .   .   .   .   .   .   .   41   HIS   H   parsed_2hwt   1   
        33   1   1   .   .   .   .   .   .   .   .   .   28   LEU   N   parsed_2hwt   1   
        33   1   2   .   .   .   .   .   .   .   .   .   93   TYR   O   parsed_2hwt   1   
        34   1   1   .   .   .   .   .   .   .   .   .   28   LEU   H   parsed_2hwt   1   
        34   1   2   .   .   .   .   .   .   .   .   .   93   TYR   O   parsed_2hwt   1   
        35   1   1   .   .   .   .   .   .   .   .   .   28   LEU   O   parsed_2hwt   1   
        35   1   2   .   .   .   .   .   .   .   .   .   93   TYR   N   parsed_2hwt   1   
        36   1   1   .   .   .   .   .   .   .   .   .   28   LEU   O   parsed_2hwt   1   
        36   1   2   .   .   .   .   .   .   .   .   .   93   TYR   H   parsed_2hwt   1   
        37   1   1   .   .   .   .   .   .   .   .   .   30   TYR   N   parsed_2hwt   1   
        37   1   2   .   .   .   .   .   .   .   .   .   91   TRP   O   parsed_2hwt   1   
        38   1   1   .   .   .   .   .   .   .   .   .   30   TYR   H   parsed_2hwt   1   
        38   1   2   .   .   .   .   .   .   .   .   .   91   TRP   O   parsed_2hwt   1   
        39   1   1   .   .   .   .   .   .   .   .   .   30   TYR   O   parsed_2hwt   1   
        39   1   2   .   .   .   .   .   .   .   .   .   91   TRP   N   parsed_2hwt   1   
        40   1   1   .   .   .   .   .   .   .   .   .   30   TYR   O   parsed_2hwt   1   
        40   1   2   .   .   .   .   .   .   .   .   .   91   TRP   H   parsed_2hwt   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   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
         2   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
         3   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
         4   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
         5   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
         6   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
         7   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
         8   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
         9   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        10   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        11   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        12   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        13   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        14   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        15   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        16   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        17   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        18   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        19   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        20   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        21   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        22   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        23   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        24   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        25   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        26   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        27   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        28   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        29   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        30   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        31   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        32   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        33   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        34   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        35   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        36   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        37   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        38   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   1   
        39   1   .   .   .   .   .   .   .   2.7   parsed_2hwt   1   
        40   1   .   .   .   .   .   .   .   1.8   parsed_2hwt   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   "HN8 protected"                                      2   35    2   49   parsed_2hwt   1   
         2   "HN46 protected"                                     5   35    5   50   parsed_2hwt   1   
         3   "HN10 protected"                                     8   36    8   51   parsed_2hwt   1   
         4   "HN44 protected"                                    11   36   11   51   parsed_2hwt   1   
         5   "HN12 protected"                                    14   36   14   51   parsed_2hwt   1   
         6   "HN42 protected"                                    17   36   17   51   parsed_2hwt   1   
         7   "Contacts B1-B4################################"    20    1   20   48   parsed_2hwt   1   
         8   "HN9 protected"                                     22   35   22   49   parsed_2hwt   1   
         9   "HN67 not protected"                                25   35   25   54   parsed_2hwt   1   
        10   "HN11 not protected"                                28   36   28   55   parsed_2hwt   1   
        11   "HN65 not protected"                                31   33   31   52   parsed_2hwt   1   
        12   "Contacts B2-B3################################"    34    2   34   49   parsed_2hwt   1   
        13   "HN29 protected"                                    35   36   35   51   parsed_2hwt   1   
        14   "HN45 protected"                                    38   36   38   51   parsed_2hwt   1   
        15   "HN31 protected"                                    41   36   41   51   parsed_2hwt   1   
        16   "HN43 protected"                                    44   36   44   51   parsed_2hwt   1   
        17   "HN33 protected"                                    47   36   47   51   parsed_2hwt   1   
        18   "HN41 protected"                                    50   36   50   51   parsed_2hwt   1   
        19   "Contacts B2-B5################################"    53    1   53   48   parsed_2hwt   1   
        20   "HN28 protected"                                    55   36   55   51   parsed_2hwt   1   
        21   "HN93 NOT protected!!"                              58   36   58   57   parsed_2hwt   1   
        22   "HN30 NOT protected!!"                              61   36   61   57   parsed_2hwt   1   
        23   "HN91 NOT protected!!"                              64   36   64   57   parsed_2hwt   1   
    stop_

save_