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
564002 2m10 18834 cing 2-parsed STAR dipolar coupling


data_2m10_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_2m10 
    _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_2m10   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_2m10 
    _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   2m10   "Master copy"    parsed_2m10   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_2m10 
    _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   2m10.mr   .   .   "MR format"    1    comment                  "Not applicable"      "Not applicable"      0   parsed_2m10   1   
        1   2m10.mr   .   .    DYANA/DIANA   2   "dihedral angle"          "Not applicable"      "Not applicable"    144   parsed_2m10   1   
        1   2m10.mr   .   .    DYANA/DIANA   3    distance                 "general distance"     simple              49   parsed_2m10   1   
        1   2m10.mr   .   .    DYANA/DIANA   4    distance                  NOE                   simple             989   parsed_2m10   1   
        1   2m10.mr   .   .   "MR format"    5    comment                  "Not applicable"      "Not applicable"      0   parsed_2m10   1   
        1   2m10.mr   .   .    XPLOR/CNS     6   "dipolar coupling"        "Not applicable"      "Not applicable"      0   parsed_2m10   1   
        1   2m10.mr   .   .   "MR format"    7   "nomenclature mapping"    "Not applicable"      "Not applicable"      0   parsed_2m10   1   
    stop_

save_


save_CNS/XPLOR_dipolar_coupling_6
    _RDC_constraint_list.Sf_category         RDC_constraints 
    _RDC_constraint_list.Entry_ID            parsed_2m10 
    _RDC_constraint_list.ID                  1 
    _RDC_constraint_list.Constraint_file_ID  1 
    _RDC_constraint_list.Block_ID            6 
    _RDC_constraint_list.Details            "Generated by Wattos" 

    loop_
        _RDC_constraint_comment_org.ID 
        _RDC_constraint_comment_org.Comment_text 
        _RDC_constraint_comment_org.Comment_begin_line 
        _RDC_constraint_comment_org.Comment_begin_column 
        _RDC_constraint_comment_org.Comment_end_line 
        _RDC_constraint_comment_org.Comment_end_column 
        _RDC_constraint_comment_org.Entry_ID 
        _RDC_constraint_comment_org.RDC_constraint_list_ID 

         1   "N.D.!     0.501  1.00E+00      1"      3   31     3   64   parsed_2m10   1   
         2   "N.D.!     0.501  1.00E+00      1"      4   26     4   59   parsed_2m10   1   
         3   "N.D.!     0.501  1.00E+00  1"          6   26     6   55   parsed_2m10   1   
         4   "N.D.!     0.501  1.00E+00  1"         17   26    17   55   parsed_2m10   1   
         5   "N.D.!     0.501  1.00E+00  1"         18   26    18   55   parsed_2m10   1   
         6   "N.D.!     0.501  1.00E+00  1"         21   26    21   55   parsed_2m10   1   
         7   "N.D.!     0.501  1.00E+00  1"         23   26    23   55   parsed_2m10   1   
         8   "N.D.!     0.501  1.00E+00  1"         28   26    28   55   parsed_2m10   1   
         9   "N.D.!     0.501  1.00E+00  1"         32   26    32   55   parsed_2m10   1   
        10   "N.D.!     0.501  1.00E+00  1"         35   26    35   55   parsed_2m10   1   
        11   "N.D.!     0.501  1.00E+00  1"         45   26    45   55   parsed_2m10   1   
        12   "N.D.!     0.501  1.00E+00  1"         79   26    79   55   parsed_2m10   1   
        13   "N.D.!     0.501  1.00E+00  1"         82   26    82   55   parsed_2m10   1   
        14   "N.D.!     0.501  1.00E+00  1"         98   26    98   55   parsed_2m10   1   
        15   "N.D.!     0.500  1.00E+00  2"        102   31   102   60   parsed_2m10   1   
        16   "N.D.!     0.500  1.00E+00  2"        103   26   103   55   parsed_2m10   1   
        17   "N.D.!     0.500  1.00E+00  2"        105   26   105   55   parsed_2m10   1   
        18   "N.D.!     0.500  1.00E+00  2"        116   26   116   55   parsed_2m10   1   
        19   "N.D.!     0.500  1.00E+00  2"        117   26   117   55   parsed_2m10   1   
        20   "N.D.!     0.500  1.00E+00  2"        120   26   120   55   parsed_2m10   1   
        21   "N.D.!     0.500  1.00E+00  2"        122   26   122   55   parsed_2m10   1   
        22   "N.D.!     0.500  1.00E+00  2"        127   26   127   55   parsed_2m10   1   
        23   "N.D.!     0.500  1.00E+00  2"        131   26   131   55   parsed_2m10   1   
        24   "N.D.!     0.500  1.00E+00  2"        134   26   134   55   parsed_2m10   1   
        25   "N.D.!     0.500  1.00E+00  2"        144   26   144   55   parsed_2m10   1   
        26   "N.D.!     0.500  1.00E+00  2"        162   26   162   55   parsed_2m10   1   
        27   "N.D.!     0.500  1.00E+00  2"        178   26   178   55   parsed_2m10   1   
        28   "N.D.!     0.500  1.00E+00  2"        181   26   181   55   parsed_2m10   1   
        29   "N.D.!     0.500  1.00E+00  2"        197   26   197   55   parsed_2m10   1   
    stop_


    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   
;
#HN RDCs measured with an IPAP-HSQC (all deconvoluted data) in Pf1
#First atom    Second atom         RDC     Error   Weight    Tensor  
#   1 GLY  H  1 GLY  N        !N.D.!     0.501  1.00E+00      1
#   2 PRO  H  2 PRO  N   !N.D.!     0.501  1.00E+00      1
   3 LYS  H  3 LYS  N        -4.95     0.501  1.00E+00  1
#   4 PRO  H  4 PRO  N   !N.D.!     0.501  1.00E+00  1
   5 GLY  H  5 GLY  N   -1.58     0.501  1.00E+00  1
   6 ASP  H  6 ASP  N   -12.45     0.501  1.00E+00  1
   7 ILE  H  7 ILE  N   7.19     0.501  1.00E+00  1
   8 PHE  H  8 PHE  N   20.10     0.501  1.00E+00  1
   9 GLU  H  9 GLU  N   16.81     0.501  1.00E+00  1
  10 VAL  H 10 VAL  N   2.49     0.501  1.00E+00  1
  11 GLU  H 11 GLU  N   2.34     0.501  1.00E+00  1
  12 LEU  H 12 LEU  N   -9.33     0.501  1.00E+00  1
  13 ALA  H 13 ALA  N   -9.27     0.501  1.00E+00  1
  14 LYS  H 14 LYS  N   -9.57     0.501  1.00E+00  1
#  15 ASN  H 15 ASN  N   !N.D.!     0.501  1.00E+00  1
#  16 ASP  H 16 ASP  N   !N.D.!     0.501  1.00E+00  1
##  17 ASN  H 17 ASN  N   21.91     0.501  1.00E+00  1
  18 SER  H 18 SER  N   -4.04     0.501  1.00E+00  1
#  19 LEU  H 19 LEU  N   !N.D.!     0.501  1.00E+00  1
  20 GLY  H 20 GLY  N   -1.00     0.501  1.00E+00  1
#  21 ILE  H 21 ILE  N   !N.D.!     0.501  1.00E+00  1
  22 CYAZ H 22 CYAZ N   -14.72     0.501  1.00E+00  1
#  23 VAL  H 23 VAL  N   -16.89     0.501  1.00E+00  1
  24 THR  H 24 THR  N   18.23     0.501  1.00E+00  1
  25 GLY  H 25 GLY  N   20.93     0.501  1.00E+00  1
#  26 GLY  H 26 GLY  N   !N.D.!     0.501  1.00E+00  1
  27 VAL  H 27 VAL  N   6.27     0.501  1.00E+00  1
  28 ASN  H 28 ASN  N   4.57     0.501  1.00E+00  1
  29 THR  H 29 THR  N   -13.52     0.501  1.00E+00  1
#  30 SER  H 30 SER  N   !N.D.!     0.501  1.00E+00  1
  31 VAL  H 31 VAL  N   -6.46     0.501  1.00E+00  1
  32 ARG  H 32 ARG  N   -10.64     0.501  1.00E+00  1
#  33 HIS  H 33 HIS  N   !N.D.!     0.501  1.00E+00  1
  34 GLY  H 34 GLY  N   -2.35     0.501  1.00E+00  1
  35 GLY  H 35 GLY  N   -7.22     0.501  1.00E+00  1
  36 ILE  H 36 ILE  N   13.14     0.501  1.00E+00  1
  37 TYR  H 37 TYR  N   23.41     0.501  1.00E+00  1
  38 VAL  H 38 VAL  N   9.44     0.501  1.00E+00  1
  39 LYS  H 39 LYS  N   -18.31     0.501  1.00E+00  1
  40 ALA  H 40 ALA  N   -7.85     0.501  1.00E+00  1
  41 VAL  H 41 VAL  N   -16.01     0.501  1.00E+00  1
  42 ILE  H 42 ILE  N   -13.55     0.501  1.00E+00  1
#  43 PRO  H 43 PRO  N   !N.D.!     0.501  1.00E+00  1
  44 GLN  H 44 GLN  N   -1.78     0.501  1.00E+00  1
  45 GLY  H 45 GLY  N   -0.57     0.501  1.00E+00  1
  46 ALA  H 46 ALA  N   0.67     0.501  1.00E+00  1
  47 ALA  H 47 ALA  N   0.90     0.501  1.00E+00  1
  48 GLU  H 48 GLU  N   8.33     0.501  1.00E+00  1
  49 SER  H 49 SER  N   0.37     0.501  1.00E+00  1
  50 ASP  H 50 ASP  N   9.05     0.501  1.00E+00  1
  51 GLY  H 51 GLY  N   14.25     0.501  1.00E+00  1
  52 ARG  H 52 ARG  N   -5.59     0.501  1.00E+00  1
  53 ILE  H 53 ILE  N   -13.39     0.501  1.00E+00  1
  54 HIS  H 54 HIS  N   -12.90     0.501  1.00E+00  1
  55 LYS  H 55 LYS  N   -21.39     0.501  1.00E+00  1
  56 GLY  H 56 GLY  N   -1.28     0.501  1.00E+00  1
  57 ASP  H 57 ASP  N   -10.36     0.501  1.00E+00  1
  58 ARG  H 58 ARG  N   15.06     0.501  1.00E+00  1
  59 VAL  H 59 VAL  N   26.51     0.501  1.00E+00  1
  60 LEU  H 60 LEU  N   9.08     0.501  1.00E+00  1
  61 ALA  H 61 ALA  N   1.67     0.501  1.00E+00  1
  62 VAL  H 62 VAL  N   -6.91     0.501  1.00E+00  1
  63 ASN  H 63 ASN  N   -13.11     0.501  1.00E+00  1
  64 GLY  H 64 GLY  N   -14.70     0.501  1.00E+00  1
  65 VAL  H 65 VAL  N   -2.93     0.501  1.00E+00  1
  66 SER  H 66 SER  N   -5.16     0.501  1.00E+00  1
  67 LEU  H 67 LEU  N   -1.57     0.501  1.00E+00  1
  68 GLU  H 68 GLU  N   22.97     0.501  1.00E+00  1
  69 GLY  H 69 GLY  N   -12.50     0.501  1.00E+00  1
  70 ALA  H 70 ALA  N   11.99     0.501  1.00E+00  1
  71 THR  H 71 THR  N   -13.59     0.501  1.00E+00  1
  72 HIS  H 72 HIS  N   13.54     0.501  1.00E+00  1
  73 LYS  H 73 LYS  N   12.99     0.501  1.00E+00  1
  74 GLN  H 74 GLN  N   4.94     0.501  1.00E+00  1
  75 ALA  H 75 ALA  N   10.26     0.501  1.00E+00  1
  76 VAL  H 76 VAL  N   20.28     0.501  1.00E+00  1
#  77 CYAZ H 77 CYAZ N   !N.D.!     0.501  1.00E+00  1
#  78 THR  H 78 THR  N   10.08     0.501  1.00E+00  1
#  79 LEU  H 79 LEU  N   -1.33     0.501  1.00E+00  1
#  80 ARG  H 80 ARG  N   !N.D.!     0.501  1.00E+00  1
  81 ASN  H 81 ASN  N   10.20     0.501  1.00E+00  1
  82 THR  H 82 THR  N   -2.67     0.501  1.00E+00  1
  83 GLY  H 83 GLY  N   0.30     0.501  1.00E+00  1
  84 GLN  H 84 GLN  N   -0.57     0.501  1.00E+00  1
  85 VAL  H 85 VAL  N   2.79     0.501  1.00E+00  1
  86 VAL  H 86 VAL  N   -15.44     0.501  1.00E+00  1
  87 HIS  H 87 HIS  N   -11.68     0.501  1.00E+00  1
  88 LEU  H 88 LEU  N   0.44     0.501  1.00E+00  1
  89 LEU  H 89 LEU  N   -13.86     0.501  1.00E+00  1
  90 LEU  H 90 LEU  N   20.92     0.501  1.00E+00  1
  91 GLU  H 91 GLU  N   18.02     0.501  1.00E+00  1
  92 LYS  H 92 LYS  N   15.08     0.501  1.00E+00  1
  93 GLY  H 93 GLY  N   -8.27     0.501  1.00E+00  1
  94 GLN  H 94 GLN  N   12.29     0.501  1.00E+00  1
  95 SER  H 95 SER  N   3.38     0.501  1.00E+00  1
#  96 PRO  H 96 PRO  N   !N.D.!     0.501  1.00E+00  1
  97 THR  H 97 THR  N   2.14     0.501  1.00E+00  1
#HN RDCs measured with an IPAP-HSQC (all deconvoluted data) in Otting phase
#First atom    Second atom        RDC     Error   Weight    Tensor  
#   1 GLY  H  1 GLY  N        !N.D.!     0.500  1.00E+00  2
#   2 PRO  H  2 PRO  N   !N.D.!     0.500  1.00E+00  2
   3 LYS  H  3 LYS  N        6.71     0.500  1.00E+00  2
#   4 PRO  H  4 PRO  N   !N.D.!     0.500  1.00E+00  2
   5 GLY  H  5 GLY  N   -0.32     0.500  1.00E+00  2
   6 ASP  H  6 ASP  N   3.16     0.500  1.00E+00  2
   7 ILE  H  7 ILE  N   3.04     0.500  1.00E+00  2
   8 PHE  H  8 PHE  N   2.97     0.500  1.00E+00  2
   9 GLU  H  9 GLU  N   2.29     0.500  1.00E+00  2
  10 VAL  H 10 VAL  N   -1.86     0.500  1.00E+00  2
  11 GLU  H 11 GLU  N   0.02     0.500  1.00E+00  2
  12 LEU  H 12 LEU  N   -2.51     0.500  1.00E+00  2
  13 ALA  H 13 ALA  N   1.23     0.500  1.00E+00  2
  14 LYS  H 14 LYS  N   7.85     0.500  1.00E+00  2
#  15 ASN  H 15 ASN  N   !N.D.!     0.500  1.00E+00  2
#  16 ASP  H 16 ASP  N   !N.D.!     0.500  1.00E+00  2
##  17 ASN  H 17 ASN  N   -0.03     0.500  1.00E+00  2
  18 SER  H 18 SER  N   -6.15     0.500  1.00E+00  2
#  19 LEU  H 19 LEU  N   !N.D.!     0.500  1.00E+00  2
  20 GLY  H 20 GLY  N   -0.01     0.500  1.00E+00  2
#  21 ILE  H 21 ILE  N   !N.D.!     0.500  1.00E+00  2
  22 CYAZ H 22 CYAZ N   -2.39     0.500  1.00E+00  2
  23 VAL  H 23 VAL  N   2.49     0.500  1.00E+00  2
  24 THR  H 24 THR  N   6.00     0.500  1.00E+00  2
  25 GLY  H 25 GLY  N   7.09     0.500  1.00E+00  2
#  26 GLY  H 26 GLY  N   !N.D.!     0.500  1.00E+00  2
  27 VAL  H 27 VAL  N   2.83     0.500  1.00E+00  2
  28 ASN  H 28 ASN  N   -1.11     0.500  1.00E+00  2
  29 THR  H 29 THR  N   0.83     0.500  1.00E+00  2
#  30 SER  H 30 SER  N   !N.D.!     0.500  1.00E+00  2
  31 VAL  H 31 VAL  N   2.01     0.500  1.00E+00  2
  32 ARG  H 32 ARG  N   1.42     0.500  1.00E+00  2
#  33 HIS  H 33 HIS  N   !N.D.!     0.500  1.00E+00  2
  34 GLY  H 34 GLY  N   3.20     0.500  1.00E+00  2
#  35 GLY  H 35 GLY  N   -2.33     0.500  1.00E+00  2
  36 ILE  H 36 ILE  N   4.44     0.500  1.00E+00  2
  37 TYR  H 37 TYR  N   4.18     0.500  1.00E+00  2
  38 VAL  H 38 VAL  N   1.30     0.500  1.00E+00  2
  39 LYS  H 39 LYS  N   -0.48     0.500  1.00E+00  2
  40 ALA  H 40 ALA  N   9.31     0.500  1.00E+00  2
  41 VAL  H 41 VAL  N   5.17     0.500  1.00E+00  2
  42 ILE  H 42 ILE  N   7.16     0.500  1.00E+00  2
#  43 PRO  H 43 PRO  N   !N.D.!     0.500  1.00E+00  2
  44 GLN  H 44 GLN  N   0.79     0.500  1.00E+00  2
#  45 GLY  H 45 GLY  N   -3.54     0.500  1.00E+00  2
  46 ALA  H 46 ALA  N   0.78     0.500  1.00E+00  2
  47 ALA  H 47 ALA  N   3.23     0.500  1.00E+00  2
  48 GLU  H 48 GLU  N   0.90     0.500  1.00E+00  2
  49 SER  H 49 SER  N   1.25     0.500  1.00E+00  2
  50 ASP  H 50 ASP  N   -1.99     0.500  1.00E+00  2
  51 GLY  H 51 GLY  N   3.66     0.500  1.00E+00  2
  52 ARG  H 52 ARG  N   -0.39     0.500  1.00E+00  2
  53 ILE  H 53 ILE  N   -2.47     0.500  1.00E+00  2
  54 HIS  H 54 HIS  N   -2.34     0.500  1.00E+00  2
  55 LYS  H 55 LYS  N   -2.16     0.500  1.00E+00  2
  56 GLY  H 56 GLY  N   1.31     0.500  1.00E+00  2
  57 ASP  H 57 ASP  N   -8.79     0.500  1.00E+00  2
  58 ARG  H 58 ARG  N   2.23     0.500  1.00E+00  2
  59 VAL  H 59 VAL  N   3.08     0.500  1.00E+00  2
  60 LEU  H 60 LEU  N   -5.15     0.500  1.00E+00  2
#  61 ALA  H 61 ALA  N   !N.D.!     0.500  1.00E+00  2
#  62 VAL  H 62 VAL  N   -9.90     0.500  1.00E+00  2
  63 ASN  H 63 ASN  N   1.28     0.500  1.00E+00  2
  64 GLY  H 64 GLY  N   5.08     0.500  1.00E+00  2
#  65 VAL  H 65 VAL  N   -3.16     0.500  1.00E+00  2
  66 SER  H 66 SER  N   7.19     0.500  1.00E+00  2
  67 LEU  H 67 LEU  N   -0.89     0.500  1.00E+00  2
  68 GLU  H 68 GLU  N   5.24     0.500  1.00E+00  2
  69 GLY  H 69 GLY  N   3.91     0.500  1.00E+00  2
  70 ALA  H 70 ALA  N   -0.85     0.500  1.00E+00  2
  71 THR  H 71 THR  N   3.29     0.500  1.00E+00  2
  72 HIS  H 72 HIS  N   -4.52     0.500  1.00E+00  2
  73 LYS  H 73 LYS  N   -6.33     0.500  1.00E+00  2
  74 GLN  H 74 GLN  N   -7.36     0.500  1.00E+00  2
  75 ALA  H 75 ALA  N   -4.56     0.500  1.00E+00  2
  76 VAL  H 76 VAL  N   -4.94     0.500  1.00E+00  2
#  77 CYAZ H 77 CYAZ N   !N.D.!     0.500  1.00E+00  2
  78 THR  H 78 THR  N   -4.10     0.500  1.00E+00  2
  79 LEU  H 79 LEU  N   -1.47     0.500  1.00E+00  2
#  80 ARG  H 80 ARG  N   !N.D.!     0.500  1.00E+00  2
#  81 ASN  H 81 ASN  N   -12.23     0.500  1.00E+00  2
  82 THR  H 82 THR  N   4.80     0.500  1.00E+00  2
  83 GLY  H 83 GLY  N   0.37     0.500  1.00E+00  2
  84 GLN  H 84 GLN  N   7.87     0.500  1.00E+00  2
  85 VAL  H 85 VAL  N   7.22     0.500  1.00E+00  2
  86 VAL  H 86 VAL  N   3.28     0.500  1.00E+00  2
  87 HIS  H 87 HIS  N   1.32     0.500  1.00E+00  2
  88 LEU  H 88 LEU  N   -4.55     0.500  1.00E+00  2
  89 LEU  H 89 LEU  N   -4.84     0.500  1.00E+00  2
  90 LEU  H 90 LEU  N   0.34     0.500  1.00E+00  2
  91 GLU  H 91 GLU  N   5.92     0.500  1.00E+00  2
  92 LYS  H 92 LYS  N   6.86     0.500  1.00E+00  2
  93 GLY  H 93 GLY  N   -7.96     0.500  1.00E+00  2
  94 GLN  H 94 GLN  N   0.57     0.500  1.00E+00  2
  95 SER  H 95 SER  N   2.72     0.500  1.00E+00  2
#  96 PRO  H 96 PRO  N   !N.D.!     0.500  1.00E+00  2
  97 THR  H 97 THR  N   1.01     0.500  1.00E+00  2
;
   1   1   198   51   parsed_2m10   1   
    stop_

save_





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