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
515563 1lud 5396 cing 2-parsed STAR distance hydrogen bond ambi 64


data_1lud_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_1lud 
    _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_1lud   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_1lud 
    _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   1lud   "Master copy"    parsed_1lud   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_1lud 
    _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   1lud.mr   .   .   "MR format"     1    comment                  "Not applicable"    "Not applicable"       0   parsed_1lud   1   
        1   1lud.mr   .   .    XPLOR/CNS      2    distance                  NOE                 simple             2445   parsed_1lud   1   
        1   1lud.mr   .   .    XPLOR/CNS      3    distance                  NOE                 ambi                 85   parsed_1lud   1   
        1   1lud.mr   .   .    XPLOR/CNS      4    distance                 "hydrogen bond"      simple              132   parsed_1lud   1   
        1   1lud.mr   .   .    XPLOR/CNS      5    distance                 "hydrogen bond"      ambi                 64   parsed_1lud   1   
        1   1lud.mr   .   .    XPLOR/CNS      6   "dihedral angle"          "Not applicable"    "Not applicable"       0   parsed_1lud   1   
        1   1lud.mr   .   .    XPLOR/CNS      7   "dipolar coupling"        "Not applicable"    "Not applicable"       0   parsed_1lud   1   
        1   1lud.mr   .   .    XPLOR/CNS      8   "dipolar coupling"        "Not applicable"    "Not applicable"       0   parsed_1lud   1   
        1   1lud.mr   .   .    XPLOR/CNS      9   "coupling constant"       "Not applicable"    "Not applicable"       0   parsed_1lud   1   
        1   1lud.mr   .   .    XPLOR/CNS     10   "chemical shift"          "Not applicable"    "Not applicable"       0   parsed_1lud   1   
        1   1lud.mr   .   .   "MR format"    11   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_1lud   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_5
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_1lud 
    _Distance_constraint_list.ID                  1 
    _Distance_constraint_list.Constraint_type    "hydrogen bond" 
    _Distance_constraint_list.Constraint_file_ID  1 
    _Distance_constraint_list.Block_ID            5 
    _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_1lud   1   
         2   1   .   .   .   parsed_1lud   1   
         3   1   .   .   .   parsed_1lud   1   
         4   1   .   .   .   parsed_1lud   1   
         5   1   .   .   .   parsed_1lud   1   
         6   1   .   .   .   parsed_1lud   1   
         7   1   .   .   .   parsed_1lud   1   
         8   1   .   .   .   parsed_1lud   1   
         9   1   .   .   .   parsed_1lud   1   
        10   1   .   .   .   parsed_1lud   1   
        11   1   .   .   .   parsed_1lud   1   
        12   1   .   .   .   parsed_1lud   1   
        13   1   .   .   .   parsed_1lud   1   
        14   1   .   .   .   parsed_1lud   1   
        15   1   .   .   .   parsed_1lud   1   
        16   1   .   .   .   parsed_1lud   1   
        17   1   .   .   .   parsed_1lud   1   
        18   1   .   .   .   parsed_1lud   1   
        19   1   .   .   .   parsed_1lud   1   
        20   1   .   .   .   parsed_1lud   1   
        21   1   .   .   .   parsed_1lud   1   
        22   1   .   .   .   parsed_1lud   1   
        23   1   .   .   .   parsed_1lud   1   
        24   1   .   .   .   parsed_1lud   1   
        25   1   .   .   .   parsed_1lud   1   
        26   1   .   .   .   parsed_1lud   1   
        27   1   .   .   .   parsed_1lud   1   
        28   1   .   .   .   parsed_1lud   1   
        29   1   .   .   .   parsed_1lud   1   
        30   1   .   .   .   parsed_1lud   1   
        31   1   .   .   .   parsed_1lud   1   
        32   1   .   .   .   parsed_1lud   1   
        33   1   .   .   .   parsed_1lud   1   
        34   1   .   .   .   parsed_1lud   1   
        35   1   .   .   .   parsed_1lud   1   
        36   1   .   .   .   parsed_1lud   1   
        37   1   .   .   .   parsed_1lud   1   
        38   1   .   .   .   parsed_1lud   1   
        39   1   .   .   .   parsed_1lud   1   
        40   1   .   .   .   parsed_1lud   1   
        41   1   .   .   .   parsed_1lud   1   
        42   1   .   .   .   parsed_1lud   1   
        43   1   .   .   .   parsed_1lud   1   
        44   1   .   .   .   parsed_1lud   1   
        45   1   .   .   .   parsed_1lud   1   
        46   1   .   .   .   parsed_1lud   1   
        47   1   .   .   .   parsed_1lud   1   
        48   1   .   .   .   parsed_1lud   1   
        49   1   .   .   .   parsed_1lud   1   
        50   1   .   .   .   parsed_1lud   1   
        51   1   .   .   .   parsed_1lud   1   
        52   1   .   .   .   parsed_1lud   1   
        53   1   .   .   .   parsed_1lud   1   
        54   1   .   .   .   parsed_1lud   1   
        55   1   .   .   .   parsed_1lud   1   
        56   1   .   .   .   parsed_1lud   1   
        57   1   .   .   .   parsed_1lud   1   
        58   1   .   .   .   parsed_1lud   1   
        59   1   .   .   .   parsed_1lud   1   
        60   1   .   .   .   parsed_1lud   1   
        61   1   .   .   .   parsed_1lud   1   
        62   1   .   .   .   parsed_1lud   1   
        63   1   .   .   .   parsed_1lud   1   
        64   1   .   .   .   parsed_1lud   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   .   hn     parsed_1lud   1   
         1   1   2   .   .   .   .   .   .   .   .   .    12   .   o      parsed_1lud   1   
         2   1   1   .   .   .   .   .   .   .   .   .     8   .   n      parsed_1lud   1   
         2   1   2   .   .   .   .   .   .   .   .   .    12   .   o      parsed_1lud   1   
         3   1   1   .   .   .   .   .   .   .   .   .     9   .   hn     parsed_1lud   1   
         3   1   2   .   .   .   .   .   .   .   .   .   118   .   o      parsed_1lud   1   
         3   1   2   .   .   .   .   .   .   .   .   .   120   .   o      parsed_1lud   1   
         4   1   1   .   .   .   .   .   .   .   .   .     9   .   n      parsed_1lud   1   
         4   1   2   .   .   .   .   .   .   .   .   .   118   .   o      parsed_1lud   1   
         4   1   2   .   .   .   .   .   .   .   .   .   120   .   o      parsed_1lud   1   
         5   1   1   .   .   .   .   .   .   .   .   .    11   .   hn     parsed_1lud   1   
         5   1   2   .   .   .   .   .   .   .   .   .     8   .   o      parsed_1lud   1   
         6   1   1   .   .   .   .   .   .   .   .   .    11   .   n      parsed_1lud   1   
         6   1   2   .   .   .   .   .   .   .   .   .     8   .   o      parsed_1lud   1   
         7   1   1   .   .   .   .   .   .   .   .   .    12   .   hn     parsed_1lud   1   
         7   1   2   .   .   .   .   .   .   .   .   .     8   .   od*    parsed_1lud   1   
         8   1   1   .   .   .   .   .   .   .   .   .    12   .   n      parsed_1lud   1   
         8   1   2   .   .   .   .   .   .   .   .   .     8   .   od*    parsed_1lud   1   
         9   1   1   .   .   .   .   .   .   .   .   .    13   .   hn     parsed_1lud   1   
         9   1   2   .   .   .   .   .   .   .   .   .   126   .   o      parsed_1lud   1   
        10   1   1   .   .   .   .   .   .   .   .   .    13   .   n      parsed_1lud   1   
        10   1   2   .   .   .   .   .   .   .   .   .   126   .   o      parsed_1lud   1   
        11   1   1   .   .   .   .   .   .   .   .   .    14   .   hn     parsed_1lud   1   
        11   1   2   .   .   .   .   .   .   .   .   .   126   .   o      parsed_1lud   1   
        12   1   1   .   .   .   .   .   .   .   .   .    14   .   n      parsed_1lud   1   
        12   1   2   .   .   .   .   .   .   .   .   .   126   .   o      parsed_1lud   1   
        13   1   1   .   .   .   .   .   .   .   .   .    15   .   hn     parsed_1lud   1   
        13   1   2   .   .   .   .   .   .   .   .   .    18   .   o      parsed_1lud   1   
        14   1   1   .   .   .   .   .   .   .   .   .    15   .   n      parsed_1lud   1   
        14   1   2   .   .   .   .   .   .   .   .   .    18   .   o      parsed_1lud   1   
        15   1   1   .   .   .   .   .   .   .   .   .    34   .   hn     parsed_1lud   1   
        15   1   2   .   .   .   .   .   .   .   .   .    31   .   o      parsed_1lud   1   
        15   1   2   .   .   .   .   .   .   .   .   .    32   .   o      parsed_1lud   1   
        16   1   1   .   .   .   .   .   .   .   .   .    34   .   n      parsed_1lud   1   
        16   1   2   .   .   .   .   .   .   .   .   .    31   .   o      parsed_1lud   1   
        16   1   2   .   .   .   .   .   .   .   .   .    32   .   o      parsed_1lud   1   
        17   1   1   .   .   .   .   .   .   .   .   .    35   .   hn     parsed_1lud   1   
        17   1   2   .   .   .   .   .   .   .   .   .    31   .   o      parsed_1lud   1   
        17   1   2   .   .   .   .   .   .   .   .   .    32   .   o      parsed_1lud   1   
        18   1   1   .   .   .   .   .   .   .   .   .    35   .   n      parsed_1lud   1   
        18   1   2   .   .   .   .   .   .   .   .   .    31   .   o      parsed_1lud   1   
        18   1   2   .   .   .   .   .   .   .   .   .    32   .   o      parsed_1lud   1   
        19   1   1   .   .   .   .   .   .   .   .   .    37   .   hn     parsed_1lud   1   
        19   1   2   .   .   .   .   .   .   .   .   .    34   .   o      parsed_1lud   1   
        20   1   1   .   .   .   .   .   .   .   .   .    37   .   n      parsed_1lud   1   
        20   1   2   .   .   .   .   .   .   .   .   .    34   .   o      parsed_1lud   1   
        21   1   1   .   .   .   .   .   .   .   .   .    57   .   hn     parsed_1lud   1   
        21   1   2   .   .   .   .   .   .   .   .   .    54   .   o      parsed_1lud   1   
        22   1   1   .   .   .   .   .   .   .   .   .    57   .   n      parsed_1lud   1   
        22   1   2   .   .   .   .   .   .   .   .   .    54   .   o      parsed_1lud   1   
        23   1   1   .   .   .   .   .   .   .   .   .    73   .   hn     parsed_1lud   1   
        23   1   2   .   .   .   .   .   .   .   .   .    70   .   o      parsed_1lud   1   
        24   1   1   .   .   .   .   .   .   .   .   .    73   .   n      parsed_1lud   1   
        24   1   2   .   .   .   .   .   .   .   .   .    70   .   o      parsed_1lud   1   
        25   1   1   .   .   .   .   .   .   .   .   .    92   .   hn     parsed_1lud   1   
        25   1   2   .   .   .   .   .   .   .   .   .    89   .   o      parsed_1lud   1   
        26   1   1   .   .   .   .   .   .   .   .   .    92   .   n      parsed_1lud   1   
        26   1   2   .   .   .   .   .   .   .   .   .    89   .   o      parsed_1lud   1   
        27   1   1   .   .   .   .   .   .   .   .   .    98   .   hn     parsed_1lud   1   
        27   1   2   .   .   .   .   .   .   .   .   .    40   .   o      parsed_1lud   1   
        28   1   1   .   .   .   .   .   .   .   .   .    98   .   n      parsed_1lud   1   
        28   1   2   .   .   .   .   .   .   .   .   .    40   .   o      parsed_1lud   1   
        29   1   1   .   .   .   .   .   .   .   .   .   128   .   hn     parsed_1lud   1   
        29   1   2   .   .   .   .   .   .   .   .   .    11   .   o      parsed_1lud   1   
        30   1   1   .   .   .   .   .   .   .   .   .   128   .   n      parsed_1lud   1   
        30   1   2   .   .   .   .   .   .   .   .   .    11   .   o      parsed_1lud   1   
        31   1   1   .   .   .   .   .   .   .   .   .   133   .   hn     parsed_1lud   1   
        31   1   2   .   .   .   .   .   .   .   .   .   131   .   o      parsed_1lud   1   
        32   1   1   .   .   .   .   .   .   .   .   .   133   .   n      parsed_1lud   1   
        32   1   2   .   .   .   .   .   .   .   .   .   131   .   o      parsed_1lud   1   
        33   1   1   .   .   .   .   .   .   .   .   .   135   .   hn     parsed_1lud   1   
        33   1   2   .   .   .   .   .   .   .   .   .   132   .   o      parsed_1lud   1   
        34   1   1   .   .   .   .   .   .   .   .   .   135   .   n      parsed_1lud   1   
        34   1   2   .   .   .   .   .   .   .   .   .   132   .   o      parsed_1lud   1   
        35   1   1   .   .   .   .   .   .   .   .   .   136   .   hn     parsed_1lud   1   
        35   1   2   .   .   .   .   .   .   .   .   .   132   .   o      parsed_1lud   1   
        36   1   1   .   .   .   .   .   .   .   .   .   136   .   n      parsed_1lud   1   
        36   1   2   .   .   .   .   .   .   .   .   .   132   .   o      parsed_1lud   1   
        37   1   1   .   .   .   .   .   .   .   .   .   140   .   hn     parsed_1lud   1   
        37   1   2   .   .   .   .   .   .   .   .   .   157   .   o      parsed_1lud   1   
        38   1   1   .   .   .   .   .   .   .   .   .   140   .   n      parsed_1lud   1   
        38   1   2   .   .   .   .   .   .   .   .   .   157   .   o      parsed_1lud   1   
        39   1   1   .   .   .   .   .   .   .   .   .   151   .   hn     parsed_1lud   1   
        39   1   2   .   .   .   .   .   .   .   .   .   148   .   o      parsed_1lud   1   
        40   1   1   .   .   .   .   .   .   .   .   .   151   .   n      parsed_1lud   1   
        40   1   2   .   .   .   .   .   .   .   .   .   148   .   o      parsed_1lud   1   
        41   1   1   .   .   .   .   .   .   .   .   .   152   .   hn     parsed_1lud   1   
        41   1   2   .   .   .   .   .   .   .   .   .   149   .   o      parsed_1lud   1   
        42   1   1   .   .   .   .   .   .   .   .   .   152   .   n      parsed_1lud   1   
        42   1   2   .   .   .   .   .   .   .   .   .   149   .   o      parsed_1lud   1   
        43   1   1   .   .   .   .   .   .   .   .   .    34   .   hg1    parsed_1lud   1   
        43   1   2   .   .   .   .   .   .   .   .   .    30   .   o      parsed_1lud   1   
        44   1   1   .   .   .   .   .   .   .   .   .    34   .   og1    parsed_1lud   1   
        44   1   2   .   .   .   .   .   .   .   .   .    30   .   o      parsed_1lud   1   
        45   1   1   .   .   .   .   .   .   .   .   .   116   .   hg1    parsed_1lud   1   
        45   1   2   .   .   .   .   .   .   .   .   .    26   .   od2    parsed_1lud   1   
        46   1   1   .   .   .   .   .   .   .   .   .   116   .   og1    parsed_1lud   1   
        46   1   2   .   .   .   .   .   .   .   .   .    26   .   od2    parsed_1lud   1   
        47   1   1   .   .   .   .   .   .   .   .   .   170   .   h1     parsed_1lud   1   
        47   1   2   .   .   .   .   .   .   .   .   .    26   .   od1    parsed_1lud   1   
        48   1   1   .   .   .   .   .   .   .   .   .   170   .   n1     parsed_1lud   1   
        48   1   2   .   .   .   .   .   .   .   .   .    26   .   od1    parsed_1lud   1   
        49   1   1   .   .   .   .   .   .   .   .   .   170   .   hn2*   parsed_1lud   1   
        49   1   2   .   .   .   .   .   .   .   .   .    26   .   od2    parsed_1lud   1   
        50   1   1   .   .   .   .   .   .   .   .   .   170   .   n2     parsed_1lud   1   
        50   1   2   .   .   .   .   .   .   .   .   .    26   .   od2    parsed_1lud   1   
        51   1   1   .   .   .   .   .   .   .   .   .     6   .   hn     parsed_1lud   1   
        51   1   2   .   .   .   .   .   .   .   .   .   168   .   o7n    parsed_1lud   1   
        52   1   1   .   .   .   .   .   .   .   .   .     6   .   n      parsed_1lud   1   
        52   1   2   .   .   .   .   .   .   .   .   .   168   .   o7n    parsed_1lud   1   
        53   1   1   .   .   .   .   .   .   .   .   .    43   .   hn     parsed_1lud   1   
        53   1   2   .   .   .   .   .   .   .   .   .    62   .   o      parsed_1lud   1   
        53   1   2   .   .   .   .   .   .   .   .   .   168   .   o4'a   parsed_1lud   1   
        54   1   1   .   .   .   .   .   .   .   .   .    43   .   n      parsed_1lud   1   
        54   1   2   .   .   .   .   .   .   .   .   .    62   .   o      parsed_1lud   1   
        54   1   2   .   .   .   .   .   .   .   .   .   168   .   o4'a   parsed_1lud   1   
        55   1   1   .   .   .   .   .   .   .   .   .    43   .   he     parsed_1lud   1   
        55   1   2   .   .   .   .   .   .   .   .   .   168   .   op#a   parsed_1lud   1   
        56   1   1   .   .   .   .   .   .   .   .   .    43   .   ne     parsed_1lud   1   
        56   1   2   .   .   .   .   .   .   .   .   .   168   .   op#a   parsed_1lud   1   
        57   1   1   .   .   .   .   .   .   .   .   .    43   .   hh11   parsed_1lud   1   
        57   1   2   .   .   .   .   .   .   .   .   .   168   .   op#a   parsed_1lud   1   
        58   1   1   .   .   .   .   .   .   .   .   .    43   .   nh1    parsed_1lud   1   
        58   1   2   .   .   .   .   .   .   .   .   .   168   .   op#a   parsed_1lud   1   
        59   1   1   .   .   .   .   .   .   .   .   .    45   .   hn     parsed_1lud   1   
        59   1   2   .   .   .   .   .   .   .   .   .   168   .   o#a    parsed_1lud   1   
        60   1   1   .   .   .   .   .   .   .   .   .    45   .   n      parsed_1lud   1   
        60   1   2   .   .   .   .   .   .   .   .   .   168   .   o#a    parsed_1lud   1   
        61   1   1   .   .   .   .   .   .   .   .   .    63   .   hg1    parsed_1lud   1   
        61   1   2   .   .   .   .   .   .   .   .   .   168   .   op#a   parsed_1lud   1   
        62   1   1   .   .   .   .   .   .   .   .   .    63   .   og1    parsed_1lud   1   
        62   1   2   .   .   .   .   .   .   .   .   .   168   .   op#a   parsed_1lud   1   
        63   1   1   .   .   .   .   .   .   .   .   .    65   .   he2#   parsed_1lud   1   
        63   1   2   .   .   .   .   .   .   .   .   .   168   .   op#a   parsed_1lud   1   
        64   1   1   .   .   .   .   .   .   .   .   .    65   .   ne2    parsed_1lud   1   
        64   1   2   .   .   .   .   .   .   .   .   .   168   .   op#a   parsed_1lud   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   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
         2   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
         3   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
         4   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
         5   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
         6   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
         7   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
         8   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
         9   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        10   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        11   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        12   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        13   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        14   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        15   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        16   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        17   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        18   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        19   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        20   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        21   1   .   .   .   .   .   2.50   1.70   3.00   parsed_1lud   1   
        22   1   .   .   .   .   .   3.50   2.80   4.00   parsed_1lud   1   
        23   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        24   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        25   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        26   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        27   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        28   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        29   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        30   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        31   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        32   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        33   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        34   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        35   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        36   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        37   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        38   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        39   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        40   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        41   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        42   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        43   1   .   .   .   .   .   2.40   1.60   2.60   parsed_1lud   1   
        44   1   .   .   .   .   .   3.40   2.70   3.60   parsed_1lud   1   
        45   1   .   .   .   .   .   2.40   1.60   2.60   parsed_1lud   1   
        46   1   .   .   .   .   .   3.40   2.70   3.60   parsed_1lud   1   
        47   1   .   .   .   .   .   2.00   1.80   2.20   parsed_1lud   1   
        48   1   .   .   .   .   .   3.00   2.80   3.20   parsed_1lud   1   
        49   1   .   .   .   .   .   2.00   1.80   2.20   parsed_1lud   1   
        50   1   .   .   .   .   .   3.00   2.80   3.20   parsed_1lud   1   
        51   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        52   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        53   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        54   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        55   1   .   .   .   .   .   2.00   1.80   2.20   parsed_1lud   1   
        56   1   .   .   .   .   .   3.00   2.80   3.20   parsed_1lud   1   
        57   1   .   .   .   .   .   2.00   1.80   2.20   parsed_1lud   1   
        58   1   .   .   .   .   .   3.00   2.80   3.20   parsed_1lud   1   
        59   1   .   .   .   .   .   2.40   1.60   2.90   parsed_1lud   1   
        60   1   .   .   .   .   .   3.40   2.70   3.90   parsed_1lud   1   
        61   1   .   .   .   .   .   2.40   1.60   2.60   parsed_1lud   1   
        62   1   .   .   .   .   .   3.40   2.70   3.60   parsed_1lud   1   
        63   1   .   .   .   .   .   2.40   1.60   2.60   parsed_1lud   1   
        64   1   .   .   .   .   .   3.40   2.70   3.60   parsed_1lud   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    turns                                                                    1   1    1    8   parsed_1lud   1   
        2   
;
Constraints below are included at the very last stage of refinement

Constraints for Asp-26 - TMP interaction
Polshakov et al., Theochem - J. Mol. Struct., 357, 207-217(1995)
;
   49   1   53   66   parsed_1lud   1   
        3   
;
Constraints for DHFR - NADPH interaction
Polshakov et al., J. Mol. Struct., 602/603, 257-267(2002)
;
   58   1   59   59   parsed_1lud   1   
        4   "Gargaro et al., Eur. J. Biochem., 238, 435-439(1996)"                   62   1   62   54   parsed_1lud   1   
        5   "H-bonds detected on comparison between complexes with/without NADPH"    69   1   69   70   parsed_1lud   1   
    stop_

save_





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