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
624495 5vkv 30286 cing 2-parsed STAR distance hydrogen bond simple


data_5vkv_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_5vkv 
    _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_5vkv   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_5vkv 
    _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   5vkv   "Master copy"    parsed_5vkv   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_5vkv 
    _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   5vkv.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"      0   parsed_5vkv   1   
        1   5vkv.mr   .   .    XPLOR/CNS     2    distance                  NOE                 simple             151   parsed_5vkv   1   
        1   5vkv.mr   .   .    XPLOR/CNS     3   "dipolar coupling"        "Not applicable"    "Not applicable"    100   parsed_5vkv   1   
        1   5vkv.mr   .   .    XPLOR/CNS     4    distance                 "hydrogen bond"      simple               0   parsed_5vkv   1   
        1   5vkv.mr   .   .    XPLOR/CNS     5    distance                  PRE                "Not applicable"      0   parsed_5vkv   1   
        1   5vkv.mr   .   .    XPLOR/CNS     6   "dihedral angle"          "Not applicable"    "Not applicable"      0   parsed_5vkv   1   
        1   5vkv.mr   .   .    XPLOR/CNS     7   "dipolar coupling"        "Not applicable"    "Not applicable"      0   parsed_5vkv   1   
        1   5vkv.mr   .   .   "MR format"    8   "nomenclature mapping"    "Not applicable"    "Not applicable"      0   parsed_5vkv   1   
    stop_

save_


save_CNS/XPLOR_distance_constraints_4
    _Distance_constraint_list.Sf_category         distance_constraints 
    _Distance_constraint_list.Entry_ID            parsed_5vkv 
    _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_parse_err.ID 
        _Dist_constraint_parse_err.Content 
        _Dist_constraint_parse_err.Begin_line 
        _Dist_constraint_parse_err.Begin_column 
        _Dist_constraint_parse_err.End_line 
        _Dist_constraint_parse_err.End_column 
        _Dist_constraint_parse_err.Entry_ID 
        _Dist_constraint_parse_err.Distance_constraint_list_ID 

         1   "# Restraints file 3: hbdb.tbl"                                                                                   1   1    1    29   parsed_5vkv   1   
         2   "assign ( don and residue   9 and segid PROT and name HN ) ( acc and residue   5 and segid PROT and name O )"     2   1    2   107   parsed_5vkv   1   
         3   "assign ( don and residue  10 and segid PROT and name HN ) ( acc and residue   6 and segid PROT and name O )"     3   1    3   107   parsed_5vkv   1   
         4   "assign ( don and residue  11 and segid PROT and name HN ) ( acc and residue   7 and segid PROT and name O )"     4   1    4   107   parsed_5vkv   1   
         5   "assign ( don and residue  12 and segid PROT and name HN ) ( acc and residue   8 and segid PROT and name O )"     5   1    5   107   parsed_5vkv   1   
         6   "assign ( don and residue  13 and segid PROT and name HN ) ( acc and residue   9 and segid PROT and name O )"     6   1    6   107   parsed_5vkv   1   
         7   "assign ( don and residue  14 and segid PROT and name HN ) ( acc and residue  10 and segid PROT and name O )"     7   1    7   107   parsed_5vkv   1   
         8   "assign ( don and residue  15 and segid PROT and name HN ) ( acc and residue  11 and segid PROT and name O )"     8   1    8   107   parsed_5vkv   1   
         9   "assign ( don and residue  16 and segid PROT and name HN ) ( acc and residue  12 and segid PROT and name O )"     9   1    9   107   parsed_5vkv   1   
        10   "assign ( don and residue  17 and segid PROT and name HN ) ( acc and residue  13 and segid PROT and name O )"    10   1   10   107   parsed_5vkv   1   
        11   "assign ( don and residue  18 and segid PROT and name HN ) ( acc and residue  14 and segid PROT and name O )"    11   1   11   107   parsed_5vkv   1   
        12   "assign ( don and residue  43 and segid PROT and name HN ) ( acc and residue  39 and segid PROT and name O )"    12   1   12   107   parsed_5vkv   1   
        13   "assign ( don and residue  46 and segid PROT and name HN ) ( acc and residue  42 and segid PROT and name O )"    13   1   13   107   parsed_5vkv   1   
        14   "assign ( don and residue  47 and segid PROT and name HN ) ( acc and residue  43 and segid PROT and name O )"    14   1   14   107   parsed_5vkv   1   
        15   "assign ( don and residue  48 and segid PROT and name HN ) ( acc and residue  44 and segid PROT and name O )"    15   1   15   107   parsed_5vkv   1   
        16   "assign ( don and residue  49 and segid PROT and name HN ) ( acc and residue  45 and segid PROT and name O )"    16   1   16   107   parsed_5vkv   1   
        17   "assign ( don and residue  50 and segid PROT and name HN ) ( acc and residue  46 and segid PROT and name O )"    17   1   17   107   parsed_5vkv   1   
        18   "assign ( don and residue  52 and segid PROT and name HN ) ( acc and residue  48 and segid PROT and name O )"    18   1   18   107   parsed_5vkv   1   
        19   "assign ( don and residue  53 and segid PROT and name HN ) ( acc and residue  49 and segid PROT and name O )"    19   1   19   107   parsed_5vkv   1   
        20   "assign ( don and residue  55 and segid PROT and name HN ) ( acc and residue  51 and segid PROT and name O )"    20   1   20   107   parsed_5vkv   1   
        21   "assign ( don and residue  56 and segid PROT and name HN ) ( acc and residue  52 and segid PROT and name O )"    21   1   21   107   parsed_5vkv   1   
        22   "assign ( don and residue  59 and segid PROT and name HN ) ( acc and residue  55 and segid PROT and name O )"    22   1   22   107   parsed_5vkv   1   
        23   "assign ( don and residue  82 and segid PROT and name HN ) ( acc and residue  78 and segid PROT and name O )"    23   1   23   107   parsed_5vkv   1   
        24   "assign ( don and residue  83 and segid PROT and name HN ) ( acc and residue  79 and segid PROT and name O )"    24   1   24   107   parsed_5vkv   1   
        25   "assign ( don and residue  84 and segid PROT and name HN ) ( acc and residue  80 and segid PROT and name O )"    25   1   25   107   parsed_5vkv   1   
        26   "assign ( don and residue  85 and segid PROT and name HN ) ( acc and residue  81 and segid PROT and name O )"    26   1   26   107   parsed_5vkv   1   
        27   "assign ( don and residue  86 and segid PROT and name HN ) ( acc and residue  82 and segid PROT and name O )"    27   1   27   107   parsed_5vkv   1   
        28   "assign ( don and residue  87 and segid PROT and name HN ) ( acc and residue  83 and segid PROT and name O )"    28   1   28   107   parsed_5vkv   1   
        29   "assign ( don and residue  88 and segid PROT and name HN ) ( acc and residue  84 and segid PROT and name O )"    29   1   29   107   parsed_5vkv   1   
        30   "assign ( don and residue  89 and segid PROT and name HN ) ( acc and residue  85 and segid PROT and name O )"    30   1   30   107   parsed_5vkv   1   
        31   "assign ( don and residue  91 and segid PROT and name HN ) ( acc and residue  87 and segid PROT and name O )"    31   1   31   107   parsed_5vkv   1   
        32   "assign ( don and residue 149 and segid PROT and name HN ) ( acc and residue 145 and segid PROT and name O )"    32   1   32   107   parsed_5vkv   1   
        33   "assign ( don and residue 150 and segid PROT and name HN ) ( acc and residue 146 and segid PROT and name O )"    33   1   33   107   parsed_5vkv   1   
        34   "assign ( don and residue 151 and segid PROT and name HN ) ( acc and residue 147 and segid PROT and name O )"    34   1   34   107   parsed_5vkv   1   
        35   "assign ( don and residue 152 and segid PROT and name HN ) ( acc and residue 148 and segid PROT and name O )"    35   1   35   107   parsed_5vkv   1   
        36   "assign ( don and residue 153 and segid PROT and name HN ) ( acc and residue 149 and segid PROT and name O )"    36   1   36   107   parsed_5vkv   1   
        37   "assign ( don and residue 154 and segid PROT and name HN ) ( acc and residue 150 and segid PROT and name O )"    37   1   37   107   parsed_5vkv   1   
        38   "assign ( don and residue 155 and segid PROT and name HN ) ( acc and residue 151 and segid PROT and name O )"    38   1   38   107   parsed_5vkv   1   
        39   "assign ( don and residue 156 and segid PROT and name HN ) ( acc and residue 152 and segid PROT and name O )"    39   1   39   107   parsed_5vkv   1   
        40   "assign ( don and residue 157 and segid PROT and name HN ) ( acc and residue 153 and segid PROT and name O )"    40   1   40   107   parsed_5vkv   1   
        41   "assign ( don and residue 159 and segid PROT and name HN ) ( acc and residue 155 and segid PROT and name O )"    41   1   41   107   parsed_5vkv   1   
        42   "assign ( don and residue 160 and segid PROT and name HN ) ( acc and residue 156 and segid PROT and name O )"    42   1   42   107   parsed_5vkv   1   
        43   "assign ( don and residue 161 and segid PROT and name HN ) ( acc and residue 157 and segid PROT and name O )"    43   1   43   107   parsed_5vkv   1   
        44   "assign ( don and residue 162 and segid PROT and name HN ) ( acc and residue 158 and segid PROT and name O )"    44   1   44   107   parsed_5vkv   1   
        45   "assign ( don and residue 163 and segid PROT and name HN ) ( acc and residue 159 and segid PROT and name O )"    45   1   45   107   parsed_5vkv   1   
        46   "assign ( don and residue 164 and segid PROT and name HN ) ( acc and residue 160 and segid PROT and name O )"    46   1   46   107   parsed_5vkv   1   
        47   "assign ( don and residue 165 and segid PROT and name HN ) ( acc and residue 161 and segid PROT and name O )"    47   1   47   107   parsed_5vkv   1   
        48   "assign ( don and residue 189 and segid PROT and name HN ) ( acc and residue 185 and segid PROT and name O )"    48   1   48   107   parsed_5vkv   1   
        49   "assign ( don and residue 190 and segid PROT and name HN ) ( acc and residue 186 and segid PROT and name O )"    49   1   49   107   parsed_5vkv   1   
        50   "assign ( don and residue 192 and segid PROT and name HN ) ( acc and residue 188 and segid PROT and name O )"    50   1   50   107   parsed_5vkv   1   
        51   "assign ( don and residue 193 and segid PROT and name HN ) ( acc and residue 189 and segid PROT and name O )"    51   1   51   107   parsed_5vkv   1   
        52   "assign ( don and residue 194 and segid PROT and name HN ) ( acc and residue 190 and segid PROT and name O )"    52   1   52   107   parsed_5vkv   1   
        53   "assign ( don and residue 195 and segid PROT and name HN ) ( acc and residue 191 and segid PROT and name O )"    53   1   53   107   parsed_5vkv   1   
        54   "assign ( don and residue 196 and segid PROT and name HN ) ( acc and residue 192 and segid PROT and name O )"    54   1   54   107   parsed_5vkv   1   
        55   "assign ( don and residue 197 and segid PROT and name HN ) ( acc and residue 193 and segid PROT and name O )"    55   1   55   107   parsed_5vkv   1   
        56   "assign ( don and residue 198 and segid PROT and name HN ) ( acc and residue 194 and segid PROT and name O )"    56   1   56   107   parsed_5vkv   1   
        57   "assign ( don and residue 199 and segid PROT and name HN ) ( acc and residue 195 and segid PROT and name O )"    57   1   57   107   parsed_5vkv   1   
    stop_

save_





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