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
50192 2jz5 15608 cing 2-parsed STAR dihedral angle


data_2jz5_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2jz5 
    _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_2jz5   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2jz5 
    _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   2jz5   "Master copy"    parsed_2jz5   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2jz5 
    _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   2jz5.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"       0   parsed_2jz5   1   
        1   2jz5.mr   .   .    DYANA/DIANA   2    distance                  NOE                 simple             1834   parsed_2jz5   1   
        1   2jz5.mr   .   .    XPLOR/CNS     3   "dihedral angle"          "Not applicable"    "Not applicable"       0   parsed_2jz5   1   
        1   2jz5.mr   .   .   "MR format"    4   "nomenclature mapping"    "Not applicable"    "Not applicable"       0   parsed_2jz5   1   
    stop_

save_


save_CNS/XPLOR_dihedral_3
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_2jz5 
    _Torsion_angle_constraint_list.ID                  1 
    _Torsion_angle_constraint_list.Constraint_file_ID  1 
    _Torsion_angle_constraint_list.Block_ID            3 
    _Torsion_angle_constraint_list.Details            "Generated by Wattos" 

    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   
;
14 VAL   PHI    -135.0   -93.0
  14 VAL   PSI     121.0   147.0
  15 ALA   PHI    -165.0   -99.0
  15 ALA   PSI     105.0   177.0
  16 ASP   PHI    -147.0   -89.0
  16 ASP   PSI     115.0   153.0
  17 VAL   PHI    -155.0  -101.0
  17 VAL   PSI     125.0   155.0
  18 THR   PHI    -133.0   -75.0
  18 THR   PSI     111.0   145.0
  19 ILE   PHI    -145.0   -99.0
  19 ILE   PSI     135.0   165.0
  25 ASP   PHI     -73.0   -51.0
  25 ASP   PSI     -51.0   -29.0
  26 ALA   PHI     -83.0   -51.0
  26 ALA   PSI     -55.0   -23.0
  27 LEU   PHI     -73.0   -49.0
  27 LEU   PSI     -59.0   -31.0
  28 GLU   PHI     -75.0   -55.0
  28 GLU   PSI     -49.0   -27.0
  29 SER   PHI     -77.0   -51.0
  29 SER   PSI     -57.0   -27.0
  30 GLU   PHI     -81.0   -53.0
  30 GLU   PSI     -57.0   -25.0
  31 LEU   PHI     -81.0   -49.0
  31 LEU   PSI     -51.0   -27.0
  32 ALA   PHI     -77.0   -51.0
  32 ALA   PSI     -57.0   -23.0
  33 LYS   PHI     -75.0   -55.0
  33 LYS   PSI     -55.0   -27.0
  34 TYR   PHI     -77.0   -55.0
  34 TYR   PSI     -63.0   -25.0
  35 ILE   PHI     -75.0   -53.0
  35 ILE   PSI     -57.0   -31.0
  36 GLU   PHI     -73.0   -51.0
  36 GLU   PSI     -53.0   -33.0
  37 LEU   PHI     -75.0   -53.0
  37 LEU   PSI     -49.0   -27.0
  38 ALA   PHI     -83.0   -53.0
  38 ALA   PSI     -53.0   -25.0
  39 LYS   PHI     -83.0   -53.0
  39 LYS   PSI     -55.0   -23.0
  40 SER   PHI     -85.0   -45.0
  40 SER   PSI     -61.0   -21.0
  46 GLU   PHI    -159.0   -75.0
  46 GLU   PSI     115.0   187.0
  47 TYR   PHI    -143.0   -95.0
  47 TYR   PSI     127.0   165.0
  48 ASN   PHI    -155.0   -99.0
  48 ASN   PSI     145.0   167.0
  49 VAL   PHI    -163.0   -67.0
  49 VAL   PSI     101.0   161.0
  58 GLU   PHI    -173.0  -105.0
  58 GLU   PSI     135.0   171.0
  59 LEU   PHI    -175.0   -81.0
  59 LEU   PSI     125.0   161.0
  60 THR   PHI    -129.0   -81.0
  60 THR   PSI     105.0   157.0
  61 ALA   PHI    -141.0  -103.0
  61 ALA   PSI     113.0   151.0
  62 ARG   PHI    -143.0   -81.0
  62 ARG   PSI     117.0   153.0
  63 PHE   PHI    -161.0   -87.0
  63 PHE   PSI     107.0   165.0
  64 LYS   PHI    -171.0   -61.0
  64 LYS   PSI      97.0   149.0
  69 ALA   PHI     -75.0   -51.0
  69 ALA   PSI     -59.0   -11.0
  71 LYS   PHI     -73.0   -51.0
  71 LYS   PSI     -59.0   -29.0
  72 LEU   PHI     -77.0   -51.0
  72 LEU   PSI     -53.0   -25.0
  73 ILE   PHI     -83.0   -49.0
  73 ILE   PSI     -55.0   -35.0
  74 PHE   PHI     -75.0   -49.0
  74 PHE   PSI     -53.0   -29.0
  75 GLU   PHI     -73.0   -51.0
  75 GLU   PSI     -53.0   -29.0
  76 LEU   PHI     -75.0   -53.0
  76 LEU   PSI     -53.0   -29.0
  77 LYS   PHI     -79.0   -47.0
  77 LYS   PSI     -57.0   -29.0
  78 THR   PHI     -75.0   -53.0
  78 THR   PSI     -63.0   -11.0
  79 ARG   PHI     -75.0   -55.0
  79 ARG   PSI     -55.0   -45.0
  80 SER   PHI     -89.0   -45.0
  80 SER   PSI     -53.0   -13.0
  81 LEU   PHI     -95.4   -45.6
  81 LEU   PSI     -77.4    19.4
   2 GLY   PHI    -315.0   -45.0
   3 GLU   PHI    -175.0   -45.0
   3 GLU   CHI1   -205.0  -105.0
   3 GLU   CHI2   -335.0   -25.0
   3 GLU   PSI      95.0   195.0
   4 ILE   PHI    -135.0   -65.0
   4 ILE   CHI1    -45.0   -25.0
   4 ILE   CHI21  -275.0   -45.0
   4 ILE   CHI21  -185.0   105.0
   4 ILE   CHI21   -65.0   195.0
   4 ILE   PSI     155.0   165.0
   5 GLY   PHI    -315.0   -45.0
   5 GLY   PSI    -125.0   125.0
   6 PHE   PHI    -315.0   -45.0
   6 PHE   PHI    -185.0    65.0
   6 PHE   CHI1   -185.0   -25.0
   6 PHE   CHI2   -335.0   -25.0
   6 PHE   CHI2   -155.0   155.0
   6 PHE   PSI     135.0   195.0
   7 ILE   PHI    -145.0   -45.0
   7 ILE   CHI1    -75.0   -35.0
   7 ILE   CHI21  -265.0   -45.0
   7 ILE   CHI21   -85.0   195.0
   7 ILE   PSI     -85.0    25.0
   8 ILE   PHI    -145.0   -45.0
   8 ILE   CHI1    -75.0   -45.0
   8 ILE   CHI21   125.0   195.0
   8 ILE   PSI     115.0   155.0
   9 LYS   PHI    -155.0   -45.0
   9 LYS   CHI1   -335.0   -25.0
   9 LYS   CHI1   -165.0    95.0
   9 LYS   CHI2   -325.0   -35.0
   9 LYS   PSI     135.0   195.0
  10 GLU   PHI    -105.0   -45.0
  10 GLU   CHI1   -125.0   -75.0
  10 GLU   CHI2   -305.0   -55.0
  10 GLU   CHI2   -195.0    65.0
  10 GLU   PSI    -195.0  -165.0
  11 GLY   PHI    -305.0   -55.0
  11 GLY   PSI    -245.0  -115.0
  12 ASP   PHI    -185.0   -45.0
  12 ASP   CHI1   -325.0    -5.0
  12 ASP   CHI1   -215.0   105.0
  12 ASP   PSI     -85.0    35.0
  13 GLU   PHI      45.0   305.0
  13 GLU   PHI    -185.0    75.0
  13 GLU   CHI1   -325.0   -25.0
  13 GLU   CHI1   -205.0    95.0
  13 GLU   CHI2   -345.0   -15.0
  13 GLU   PSI     -25.0    95.0
  14 VAL   CHI1     45.0   205.0
  14 VAL   CHI1   -195.0    85.0
  16 ASP   CHI1   -325.0    -5.0
  16 ASP   CHI1   -205.0    65.0
  16 ASP   CHI1    -75.0   205.0
  17 VAL   CHI1     45.0   205.0
  17 VAL   CHI1   -185.0    65.0
  18 THR   CHI1    -75.0    -5.0
  19 ILE   CHI1    -65.0   -25.0
  19 ILE   CHI21  -275.0   -45.0
  19 ILE   CHI21   -75.0   195.0
  20 PHE   PHI    -315.0   -45.0
  20 PHE   PHI    -185.0    75.0
  20 PHE   CHI1   -325.0   -25.0
  20 PHE   CHI1   -195.0    95.0
  20 PHE   CHI2   -335.0   -25.0
  20 PHE   CHI2   -155.0   155.0
  20 PHE   PSI     125.0   195.0
  21 ALA   PHI    -315.0   -45.0
  21 ALA   PHI    -185.0    75.0
  21 ALA   PSI     135.0   195.0
  22 GLU   PHI    -155.0   -45.0
  22 GLU   CHI1   -125.0   -25.0
  22 GLU   CHI2   -325.0   -15.0
  22 GLU   PSI     -85.0    15.0
  23 THR   PHI    -315.0   -45.0
  23 THR   PHI    -155.0    65.0
  23 THR   CHI1    -15.0    95.0
  23 THR   PSI     135.0   195.0
  24 LYS   PHI    -145.0   -45.0
  24 LYS   CHI1   -205.0  -125.0
  24 LYS   CHI2   -325.0   -35.0
  24 LYS   PSI     -85.0   -15.0
  25 ASP   CHI1   -215.0   -35.0
  27 LEU   CHI1   -145.0   -65.0
  27 LEU   CHI2   -295.0   -45.0
  27 LEU   CHI2    -85.0   125.0
  28 GLU   CHI1    -95.0   -35.0
  28 GLU   CHI2   -265.0   -75.0
  29 SER   CHI1   -315.0   -15.0
  29 SER   CHI1   -195.0    85.0
  30 GLU   CHI1   -135.0   -95.0
  30 GLU   CHI2   -245.0   -35.0
  31 LEU   CHI1   -165.0   -85.0
  31 LEU   CHI2   -325.0   -35.0
  31 LEU   CHI2   -245.0    95.0
  31 LEU   CHI2    -85.0   195.0
  33 LYS   CHI1    -85.0   -35.0
  33 LYS   CHI2   -265.0   -45.0
  34 TYR   CHI1   -205.0   -35.0
  34 TYR   CHI2   -335.0   -25.0
  34 TYR   CHI2   -155.0   155.0
  35 ILE   CHI1    -75.0   -35.0
  35 ILE   CHI21    95.0   195.0
  36 GLU   CHI1   -155.0   -85.0
  36 GLU   CHI2     35.0   315.0
  37 LEU   CHI1   -155.0   -35.0
  37 LEU   CHI2   -325.0   -35.0
  37 LEU   CHI2    -95.0   205.0
  39 LYS   CHI1   -325.0   -35.0
  39 LYS   CHI1   -125.0    75.0
  39 LYS   CHI2   -295.0   -35.0
  41 VAL   PHI    -155.0   -45.0
  41 VAL   CHI1   -195.0  -155.0
  41 VAL   PSI     -85.0   -25.0
  42 CYS   PHI    -315.0   -45.0
  42 CYS   PHI    -185.0    75.0
  42 CYS   CHI1   -335.0   -25.0
  42 CYS   CHI1   -205.0    75.0
  42 CYS   PSI      15.0   195.0
  42 CYS   PSI    -175.0   175.0
  43 ALA   PHI    -315.0   -45.0
  43 ALA   PHI    -185.0    75.0
  43 ALA   PSI    -275.0    35.0
  43 ALA   PSI     -85.0   105.0
  44 GLY   PHI    -315.0   -45.0
  44 GLY   PSI    -105.0   105.0
  45 VAL   PHI    -125.0   -45.0
  45 VAL   CHI1     45.0    85.0
  45 VAL   PSI     115.0   165.0
  46 GLU   CHI1   -325.0   -25.0
  46 GLU   CHI1   -205.0    95.0
  46 GLU   CHI1   -145.0   165.0
  46 GLU   CHI2   -345.0   -15.0
  47 TYR   CHI1   -335.0   -25.0
  47 TYR   CHI1   -175.0    75.0
  47 TYR   CHI1    -95.0   205.0
  47 TYR   CHI2   -315.0   -25.0
  47 TYR   CHI2   -135.0   155.0
  48 ASN   CHI1    -65.0    -5.0
  48 ASN   CHI2     75.0   145.0
  49 VAL   CHI1     45.0   205.0
  49 VAL   CHI1   -195.0    85.0
  50 SER   PHI    -315.0   -45.0
  50 SER   PHI    -185.0    75.0
  50 SER   CHI1    -75.0    55.0
  50 SER   PSI     145.0   205.0
  51 GLU   PHI    -315.0   -45.0
  51 GLU   PHI    -175.0    65.0
  51 GLU   CHI1   -335.0   -25.0
  51 GLU   CHI1   -145.0    95.0
  51 GLU   CHI2   -345.0   -15.0
  51 GLU   PSI     105.0   195.0
  52 LEU   PHI    -145.0   -45.0
  52 LEU   CHI1   -325.0   -15.0
  52 LEU   CHI1   -275.0    45.0
  52 LEU   CHI1   -135.0   105.0
  52 LEU   CHI2     45.0   295.0
  52 LEU   CHI2    -95.0   205.0
  52 LEU   PSI     115.0   205.0
  53 THR   PHI    -315.0   -45.0
  53 THR   PHI    -185.0    75.0
  53 THR   CHI1    -25.0    95.0
  53 THR   PSI     135.0   195.0
  54 GLU   PHI    -165.0   -45.0
  54 GLU   CHI1   -315.0   -35.0
  54 GLU   CHI1   -205.0    75.0
  54 GLU   CHI2   -335.0   -25.0
  54 GLU   PSI     -85.0     5.0
  55 GLU   PHI    -165.0   -45.0
  55 GLU   CHI1   -325.0   -25.0
  55 GLU   CHI1   -205.0    95.0
  55 GLU   CHI1   -155.0   165.0
  55 GLU   CHI2   -345.0   -15.0
  55 GLU   PSI     -85.0    85.0
  56 SER   PHI    -165.0   -45.0
  56 SER   CHI1   -345.0   -15.0
  56 SER   PSI      85.0   195.0
  57 LYS   PHI    -315.0   -45.0
  57 LYS   PHI    -185.0    75.0
  57 LYS   CHI1   -335.0   -25.0
  57 LYS   CHI1   -205.0    95.0
  57 LYS   CHI2   -325.0   -35.0
  57 LYS   PSI     -85.0   105.0
  58 GLU   CHI1   -335.0   -25.0
  58 GLU   CHI1   -205.0    95.0
  58 GLU   CHI1   -145.0   165.0
  58 GLU   CHI2   -345.0   -15.0
  59 LEU   CHI1   -325.0   -35.0
  59 LEU   CHI1   -125.0    95.0
  59 LEU   CHI2   -305.0   -35.0
  59 LEU   CHI2    -95.0   175.0
  60 THR   CHI1   -175.0    35.0
  60 THR   CHI1    -75.0   205.0
  62 ARG   CHI1   -335.0   -25.0
  62 ARG   CHI1   -205.0    95.0
  62 ARG   CHI2   -325.0   -35.0
  63 PHE   CHI1   -335.0   -25.0
  63 PHE   CHI1   -205.0    95.0
  63 PHE   CHI2   -335.0   -25.0
  63 PHE   CHI2   -155.0   155.0
  64 LYS   CHI1   -325.0   -25.0
  64 LYS   CHI1   -205.0    95.0
  64 LYS   CHI2   -325.0   -35.0
  65 PHE   PHI    -315.0   -45.0
  65 PHE   PHI    -185.0    75.0
  65 PHE   CHI1   -335.0   -25.0
  65 PHE   CHI1   -145.0    85.0
  65 PHE   CHI2   -335.0   -25.0
  65 PHE   CHI2   -155.0   155.0
  65 PHE   PSI    -215.0   -15.0
  65 PHE   PSI     -25.0   195.0
  66 GLU   PHI    -135.0   -45.0
  66 GLU   CHI1   -145.0   -35.0
  66 GLU   CHI2   -335.0   -25.0
  66 GLU   PSI     -85.0   -15.0
  67 VAL   PHI    -165.0   -45.0
  67 VAL   CHI1    -95.0   -45.0
  67 VAL   PSI     135.0   195.0
  68 SER   PHI    -315.0   -45.0
  68 SER   PHI    -185.0    65.0
  68 SER   PSI     -35.0    35.0
  70 GLU   PHI    -125.0   -45.0
  70 GLU   CHI1   -115.0   -25.0
  70 GLU   CHI2   -285.0   -15.0
  70 GLU   PSI     -85.0     5.0
  71 LYS   CHI1   -155.0  -105.0
  71 LYS   CHI2   -315.0   -35.0
  72 LEU   CHI1    -85.0   -45.0
  72 LEU   CHI2     85.0   135.0
  73 ILE   CHI1    -75.0   -55.0
  73 ILE   CHI21  -285.0   -45.0
  73 ILE   CHI21   -75.0   195.0
  74 PHE   CHI1   -205.0  -115.0
  74 PHE   CHI2   -335.0   -25.0
  74 PHE   CHI2   -155.0   155.0
  75 GLU   CHI1   -315.0   -35.0
  75 GLU   CHI1   -115.0    85.0
  75 GLU   CHI2   -285.0   -25.0
  76 LEU   CHI1   -125.0   -95.0
  76 LEU   CHI2    125.0   195.0
  77 LYS   CHI1   -325.0   -25.0
  77 LYS   CHI1   -205.0    95.0
  77 LYS   CHI2   -325.0   -35.0
  78 THR   CHI1    -15.0    85.0
  79 ARG   CHI1   -105.0   -85.0
  79 ARG   CHI2   -155.0   -85.0
  79 ARG   CHI2   -115.0   225.0
  80 SER   CHI1   -285.0    45.0
  80 SER   CHI1    -45.0   285.0
  82 ALA   PHI      45.0   285.0
  82 ALA   PHI    -185.0    75.0
  82 ALA   PSI       5.0   125.0
;
   1   3   343   32   parsed_2jz5   1   
    stop_

save_





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Contact the webmaster for help, if required. Tuesday, May 28, 2024 7:47:21 PM GMT (wattos1)