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
617350 5nda 34114 cing 2-parsed STAR dihedral angle


data_5nda_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_5nda 
    _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_5nda   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_5nda 
    _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   5nda   "Master copy"    parsed_5nda   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_5nda 
    _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   5nda.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"    0   parsed_5nda   1   
        1   5nda.mr   .   .    DYANA/DIANA   2   "dihedral angle"          "Not applicable"    "Not applicable"    0   parsed_5nda   1   
        1   5nda.mr   .   .    DYANA/DIANA   3    distance                  NOE                 simple             0   parsed_5nda   1   
        1   5nda.mr   .   .   "MR format"    4   "nomenclature mapping"    "Not applicable"    "Not applicable"    0   parsed_5nda   1   
    stop_

save_


save_DYANA/DIANA_dihedral_2
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_5nda 
    _Torsion_angle_constraint_list.ID                  1 
    _Torsion_angle_constraint_list.Constraint_file_ID  1 
    _Torsion_angle_constraint_list.Block_ID            2 
    _Torsion_angle_constraint_list.Details            "Generated by Wattos" 

    loop_
        _TA_constraint_comment_org.ID 
        _TA_constraint_comment_org.Comment_text 
        _TA_constraint_comment_org.Comment_begin_line 
        _TA_constraint_comment_org.Comment_begin_column 
        _TA_constraint_comment_org.Comment_end_line 
        _TA_constraint_comment_org.Comment_end_column 
        _TA_constraint_comment_org.Entry_ID 
        _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 

        1   "Restraints file 1: D_1200003777.aco"    1   1   1   37   parsed_5nda   1   
    stop_


    loop_
        _TA_constraint_parse_err.ID 
        _TA_constraint_parse_err.Content 
        _TA_constraint_parse_err.Begin_line 
        _TA_constraint_parse_err.Begin_column 
        _TA_constraint_parse_err.End_line 
        _TA_constraint_parse_err.End_column 
        _TA_constraint_parse_err.Entry_ID 
        _TA_constraint_parse_err.Torsion_angle_constraint_list_ID 

         1   "4   SER  PHI     -88,6   -48,6"      2   4    2   34   parsed_5nda   1   
         2   "4   SER  PSI     122,1   162,1"      3   4    3   34   parsed_5nda   1   
         3   "6   VAL  PHI     -84,9   -44,9"      4   4    4   34   parsed_5nda   1   
         4   "6   VAL  PSI     -56,0   -14,8"      5   4    5   34   parsed_5nda   1   
         5   "7   HIS  PHI     -87,2   -47,2"      6   4    6   34   parsed_5nda   1   
         6   "7   HIS  PSI     -58,8    12,5"      7   4    7   34   parsed_5nda   1   
         7   "8   LEU  PHI     -87,0   -47,0"      8   4    8   34   parsed_5nda   1   
         8   "8   LEU  PSI     -55,6   -10,1"      9   4    9   34   parsed_5nda   1   
         9   "9   LYS  PHI     -87,2   -47,2"     10   4   10   34   parsed_5nda   1   
        10   "9   LYS  PSI     -55,8   -15,8"     11   4   11   34   parsed_5nda   1   
        11   "10   ARG  PHI     -85,1   -45,1"    12   3   12   34   parsed_5nda   1   
        12   "10   ARG  PSI     -59,8   -14,3"    13   3   13   34   parsed_5nda   1   
        13   "11   LEU  PHI     -89,2   -49,2"    14   3   14   34   parsed_5nda   1   
        14   "11   LEU  PSI     -57,0   -14,8"    15   3   15   34   parsed_5nda   1   
        15   "12   LYS  PHI     -84,2   -44,2"    16   3   16   34   parsed_5nda   1   
        16   "12   LYS  PSI     -55,1   -11,4"    17   3   17   34   parsed_5nda   1   
        17   "13   LEU  PHI     -89,6   -49,6"    18   3   18   34   parsed_5nda   1   
        18   "13   LEU  PSI     -58,6   -18,6"    19   3   19   34   parsed_5nda   1   
        19   "14   LEU  PHI     -84,8   -44,8"    20   3   20   34   parsed_5nda   1   
        20   "14   LEU  PSI     -57,0   -17,0"    21   3   21   34   parsed_5nda   1   
        21   "15   LEU  PHI     -87,2   -47,2"    22   3   22   34   parsed_5nda   1   
        22   "15   LEU  PSI     -56,9    -0,5"    23   3   23   34   parsed_5nda   1   
        23   "16   LEU  PHI     -90,6   -50,6"    24   3   24   34   parsed_5nda   1   
        24   "16   LEU  PSI     -60,9   -12,5"    25   3   25   34   parsed_5nda   1   
        25   "17   LEU  PHI     -85,4   -45,4"    26   3   26   34   parsed_5nda   1   
        26   "17   LEU  PSI     -57,2   -15,9"    27   3   27   34   parsed_5nda   1   
        27   "18   LEU  PHI     -87,8   -47,8"    28   3   28   34   parsed_5nda   1   
        28   "18   LEU  PSI     -56,5    -2,4"    29   3   29   34   parsed_5nda   1   
        29   "19   LEU  PHI     -91,9   -51,9"    30   3   30   34   parsed_5nda   1   
        30   "19   LEU  PSI     -56,8    -8,2"    31   3   31   34   parsed_5nda   1   
        31   "20   LEU  PHI     -87,2   -47,2"    32   3   32   34   parsed_5nda   1   
        32   "20   LEU  PSI     -57,0   -17,0"    33   3   33   34   parsed_5nda   1   
        33   "21   ILE  PHI     -83,6   -43,6"    34   3   34   34   parsed_5nda   1   
        34   "21   ILE  PSI     -60,0   -19,4"    35   3   35   34   parsed_5nda   1   
        35   "22   LEU  PHI     -86,6   -46,6"    36   3   36   34   parsed_5nda   1   
        36   "22   LEU  PSI     -73,1    -3,2"    37   3   37   34   parsed_5nda   1   
        37   "23   LEU  PHI     -96,5   -51,3"    38   3   38   34   parsed_5nda   1   
        38   "23   LEU  PSI     -57,0    -8,1"    39   3   39   34   parsed_5nda   1   
        39   "24   LEU  PHI     -84,9   -44,9"    40   3   40   34   parsed_5nda   1   
        40   "24   LEU  PSI     -63,8   -23,8"    41   3   41   34   parsed_5nda   1   
        41   "25   ILE  PHI     -83,4   -43,4"    42   3   42   34   parsed_5nda   1   
        42   "25   ILE  PSI     -64,5   -24,5"    43   3   43   34   parsed_5nda   1   
        43   "26   LEU  PHI     -85,8   -45,8"    44   3   44   34   parsed_5nda   1   
        44   "26   LEU  PSI     -58,9    -2,8"    45   3   45   34   parsed_5nda   1   
        45   "27   GLY  PHI     -86,1   -46,1"    46   3   46   34   parsed_5nda   1   
        46   "27   GLY  PSI     -55,7    -2,4"    47   3   47   34   parsed_5nda   1   
        47   "28   ALA  PHI     -85,4   -45,4"    48   3   48   34   parsed_5nda   1   
        48   "28   ALA  PSI     -60,9   -20,9"    49   3   49   34   parsed_5nda   1   
        49   "29   LEU  PHI     -90,1   -50,1"    50   3   50   34   parsed_5nda   1   
        50   "29   LEU  PSI     -62,0    -7,8"    51   3   51   34   parsed_5nda   1   
        51   "30   LEU  PHI    -102,2   -55,6"    52   3   52   34   parsed_5nda   1   
        52   "30   LEU  PSI     -59,9    -5,5"    53   3   53   34   parsed_5nda   1   
        53   "31   LEU  PHI    -121,4   -79,4"    54   3   54   34   parsed_5nda   1   
        54   "31   LEU  PSI     -29,8    30,4"    55   3   55   34   parsed_5nda   1   
        55   "32   GLY  PHI      39,8   121,6"    56   3   56   34   parsed_5nda   1   
        56   "32   GLY  PSI     -22,6    59,6"    57   3   57   34   parsed_5nda   1   
    stop_

save_





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