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
494528 2krm 16641 cing 2-parsed STAR dipolar coupling


data_2krm_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2krm 
    _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_2krm   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2krm 
    _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   2krm   "Master copy"    parsed_2krm   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2krm 
    _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   2krm.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"    0   parsed_2krm   1   
        1   2krm.mr   .   .    XPLOR/CNS     2   "dipolar coupling"        "Not applicable"    "Not applicable"    0   parsed_2krm   1   
        1   2krm.mr   .   .   "MR format"    3   "nomenclature mapping"    "Not applicable"    "Not applicable"    0   parsed_2krm   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_2
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_2krm 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            2 
    _RDC_constraint_list.Details            "Generated by Wattos" 

    loop_
        _RDC_constraint_parse_err.ID 
        _RDC_constraint_parse_err.Content 
        _RDC_constraint_parse_err.Begin_line 
        _RDC_constraint_parse_err.Begin_column 
        _RDC_constraint_parse_err.End_line 
        _RDC_constraint_parse_err.End_column 
        _RDC_constraint_parse_err.Entry_ID 
        _RDC_constraint_parse_err.RDC_constraint_list_ID 

         1   "assign ( resid  3 and name HN ) ( resid  3 and name  N )  43.707  1.0  1.00 0"     1   1    1   77   parsed_2krm   1   
         2   "assign ( resid  4 and name HN ) ( resid  4 and name  N )   3.677  1.0  1.00 0"     2   1    2   77   parsed_2krm   1   
         3   "assign ( resid  5 and name HN ) ( resid  5 and name  N ) -10.600  1.0  1.00 0"     3   1    3   77   parsed_2krm   1   
         4   "assign ( resid  6 and name HN ) ( resid  6 and name  N ) -22.408  1.0  1.00 0"     4   1    4   77   parsed_2krm   1   
         5   "assign ( resid  7 and name HN ) ( resid  7 and name  N )  -2.368  1.0  1.00 0"     5   1    5   77   parsed_2krm   1   
         6   "assign ( resid 11 and name HN ) ( resid 11 and name  N ) -31.157  1.0  1.00 0"     6   1    6   77   parsed_2krm   1   
         7   "assign ( resid 12 and name HN ) ( resid 12 and name  N )  -8.433  1.0  1.00 0"     7   1    7   77   parsed_2krm   1   
         8   "assign ( resid 13 and name HN ) ( resid 13 and name  N )  15.806  1.0  1.00 0"     8   1    8   77   parsed_2krm   1   
         9   "assign ( resid 14 and name HN ) ( resid 14 and name  N )  36.548  1.0  1.00 0"     9   1    9   77   parsed_2krm   1   
        10   "assign ( resid 16 and name HN ) ( resid 16 and name  N )  -0.268  1.0  1.00 0"    10   1   10   77   parsed_2krm   1   
        11   "assign ( resid 17 and name HN ) ( resid 17 and name  N )  37.227  1.0  1.00 0"    11   1   11   77   parsed_2krm   1   
        12   "assign ( resid 18 and name HN ) ( resid 18 and name  N )  -2.802  1.0  1.00 0"    12   1   12   77   parsed_2krm   1   
        13   "assign ( resid 19 and name HN ) ( resid 19 and name  N ) -27.812  1.0  1.00 0"    13   1   13   77   parsed_2krm   1   
        14   "assign ( resid 20 and name HN ) ( resid 20 and name  N ) -17.934  1.0  1.00 0"    14   1   14   77   parsed_2krm   1   
        15   "assign ( resid 21 and name HN ) ( resid 21 and name  N ) -23.505  1.0  1.00 0"    15   1   15   77   parsed_2krm   1   
        16   "assign ( resid 22 and name HN ) ( resid 22 and name  N )   4.981  1.0  1.00 0"    16   1   16   77   parsed_2krm   1   
        17   "assign ( resid 23 and name HN ) ( resid 23 and name  N )  -9.965  1.0  1.00 0"    17   1   17   77   parsed_2krm   1   
        18   "assign ( resid 24 and name HN ) ( resid 24 and name  N )   7.104  1.0  1.00 0"    18   1   18   77   parsed_2krm   1   
        19   "assign ( resid 25 and name HN ) ( resid 25 and name  N ) -16.870  1.0  1.00 0"    19   1   19   77   parsed_2krm   1   
        20   "assign ( resid 26 and name HN ) ( resid 26 and name  N )  -8.691  1.0  1.00 0"    20   1   20   77   parsed_2krm   1   
        21   "assign ( resid 27 and name HN ) ( resid 27 and name  N )  22.548  1.0  1.00 0"    21   1   21   77   parsed_2krm   1   
        22   "assign ( resid 28 and name HN ) ( resid 28 and name  N )  39.854  1.0  1.00 0"    22   1   22   77   parsed_2krm   1   
        23   "assign ( resid 29 and name HN ) ( resid 29 and name  N )  31.254  1.0  1.00 0"    23   1   23   77   parsed_2krm   1   
        24   "assign ( resid 30 and name HN ) ( resid 30 and name  N )  28.740  1.0  1.00 0"    24   1   24   77   parsed_2krm   1   
        25   "assign ( resid 31 and name HN ) ( resid 31 and name  N )  16.553  1.0  1.00 0"    25   1   25   77   parsed_2krm   1   
        26   "assign ( resid 32 and name HN ) ( resid 32 and name  N ) -25.611  1.0  1.00 0"    26   1   26   77   parsed_2krm   1   
        27   "assign ( resid 33 and name HN ) ( resid 33 and name  N )  -0.835  1.0  1.00 0"    27   1   27   77   parsed_2krm   1   
        28   "assign ( resid 34 and name HN ) ( resid 34 and name  N ) -16.426  1.0  1.00 0"    28   1   28   77   parsed_2krm   1   
        29   "assign ( resid 35 and name HN ) ( resid 35 and name  N )   7.622  1.0  1.00 0"    29   1   29   77   parsed_2krm   1   
        30   "assign ( resid 36 and name HN ) ( resid 36 and name  N )  26.943  1.0  1.00 0"    30   1   30   77   parsed_2krm   1   
        31   "assign ( resid 37 and name HN ) ( resid 37 and name  N )  -5.313  1.0  1.00 0"    31   1   31   77   parsed_2krm   1   
        32   "assign ( resid 38 and name HN ) ( resid 38 and name  N )  -0.431  1.0  1.00 0"    32   1   32   77   parsed_2krm   1   
        33   "assign ( resid 39 and name HN ) ( resid 39 and name  N )  35.668  1.0  1.00 0"    33   1   33   77   parsed_2krm   1   
        34   "assign ( resid 40 and name HN ) ( resid 40 and name  N )  35.864  1.0  1.00 0"    34   1   34   77   parsed_2krm   1   
        35   "assign ( resid 41 and name HN ) ( resid 41 and name  N )  40.239  1.0  1.00 0"    35   1   35   77   parsed_2krm   1   
        36   "assign ( resid 42 and name HN ) ( resid 42 and name  N )  32.421  1.0  1.00 0"    36   1   36   77   parsed_2krm   1   
        37   "assign ( resid 43 and name HN ) ( resid 43 and name  N )  41.055  1.0  1.00 0"    37   1   37   77   parsed_2krm   1   
        38   "assign ( resid 44 and name HN ) ( resid 44 and name  N )  32.139  1.0  1.00 0"    38   1   38   77   parsed_2krm   1   
        39   "assign ( resid 45 and name HN ) ( resid 45 and name  N )  -8.022  1.0  1.00 0"    39   1   39   77   parsed_2krm   1   
        40   "assign ( resid 46 and name HN ) ( resid 46 and name  N )   5.723  1.0  1.00 0"    40   1   40   77   parsed_2krm   1   
        41   "assign ( resid 47 and name HN ) ( resid 47 and name  N )  42.700  1.0  1.00 0"    41   1   41   77   parsed_2krm   1   
        42   "assign ( resid 48 and name HN ) ( resid 48 and name  N )  39.429  1.0  1.00 0"    42   1   42   77   parsed_2krm   1   
        43   "assign ( resid 49 and name HN ) ( resid 49 and name  N )  13.911  1.0  1.00 0"    43   1   43   77   parsed_2krm   1   
        44   "assign ( resid 51 and name HN ) ( resid 51 and name  N )   9.262  1.0  1.00 0"    44   1   44   77   parsed_2krm   1   
        45   "assign ( resid 52 and name HN ) ( resid 52 and name  N )  35.005  1.0  1.00 0"    45   1   45   77   parsed_2krm   1   
        46   "assign ( resid 53 and name HN ) ( resid 53 and name  N ) -14.453  1.0  1.00 0"    46   1   46   77   parsed_2krm   1   
        47   "assign ( resid 54 and name HN ) ( resid 54 and name  N )  -5.839  1.0  1.00 0"    47   1   47   77   parsed_2krm   1   
        48   "assign ( resid 55 and name HN ) ( resid 55 and name  N ) -15.732  1.0  1.00 0"    48   1   48   77   parsed_2krm   1   
        49   "assign ( resid 56 and name HN ) ( resid 56 and name  N ) -20.074  1.0  1.00 0"    49   1   49   77   parsed_2krm   1   
        50   "assign ( resid 57 and name HN ) ( resid 57 and name  N )  -5.893  1.0  1.00 0"    50   1   50   77   parsed_2krm   1   
        51   "assign ( resid 58 and name HN ) ( resid 58 and name  N ) -26.714  1.0  1.00 0"    51   1   51   77   parsed_2krm   1   
        52   "assign ( resid 59 and name HN ) ( resid 59 and name  N )  -6.850  1.0  1.00 0"    52   1   52   77   parsed_2krm   1   
        53   "assign ( resid 60 and name HN ) ( resid 60 and name  N )  -7.730  1.0  1.00 0"    53   1   53   77   parsed_2krm   1   
        54   "assign ( resid 61 and name HN ) ( resid 61 and name  N )  -4.781  1.0  1.00 0"    54   1   54   77   parsed_2krm   1   
        55   "assign ( resid 62 and name HN ) ( resid 62 and name  N )  -1.904  1.0  1.00 0"    55   1   55   77   parsed_2krm   1   
        56   "assign ( resid 10 and name HN ) ( resid 10 and name  N ) -23.359  1.0  1.00 0"    56   1   56   77   parsed_2krm   1   
        57   "assign ( resid  9 and name HN ) ( resid  9 and name  N ) -30.010  1.0  1.00 0"    57   1   57   77   parsed_2krm   1   
        58   "assign ( resid  8 and name HN ) ( resid  8 and name  N ) -24.576  1.0  1.00 0"    58   1   58   77   parsed_2krm   1   
    stop_

save_





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