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
647893 6k59 36258 cing 2-parsed STAR dihedral angle


data_6k59_MR_file_constraints


save_Conversion_project
    _Study_list.Sf_category  study_list 
    _Study_list.Entry_ID     parsed_6k59 
    _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_6k59   1   
    stop_

save_


save_entry_information
    _Entry.Sf_category                  entry_information 
    _Entry.ID                           parsed_6k59 
    _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   6k59   "Master copy"    parsed_6k59   
    stop_

save_


save_global_Org_file_characteristics
    _Constraint_stat_list.Sf_category  constraint_statistics 
    _Constraint_stat_list.Entry_ID     parsed_6k59 
    _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   6k59.mr   .   .   "MR format"    1    comment                  "Not applicable"    "Not applicable"    0   parsed_6k59   1   
        1   6k59.mr   .   .    DYANA/DIANA   2    distance                  NOE                 simple             0   parsed_6k59   1   
        1   6k59.mr   .   .    DYANA/DIANA   3   "dihedral angle"          "Not applicable"    "Not applicable"    0   parsed_6k59   1   
        1   6k59.mr   .   .   "MR format"    4   "nomenclature mapping"    "Not applicable"    "Not applicable"    0   parsed_6k59   1   
    stop_

save_


save_DYANA/DIANA_dihedral_3
    _Torsion_angle_constraint_list.Sf_category         torsion_angle_constraints 
    _Torsion_angle_constraint_list.Entry_ID            parsed_6k59 
    _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_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 2: GLARGINE_INSULIN.aco"        1   1   1   41   parsed_6k59   1   
        2   "Torsion angle constraintS"                      2   1   2   64   parsed_6k59   1   
        3   "generated from HA secondary chemical shifts"    3   1   3   80   parsed_6k59   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   "1	GLY	A	PSI	-120	120"       4   1     4   44   parsed_6k59   1   
          2   "2	ILE	A	PHI	-120	-30"       5   1     5   44   parsed_6k59   1   
          3   "2	ILE	A	PSI	-120	120"       6   1     6   44   parsed_6k59   1   
          4   "3	VAL	A	PHI	-120	-30"       7   1     7   44   parsed_6k59   1   
          5   "3	VAL	A	PSI	-120	120"       8   1     8   44   parsed_6k59   1   
          6   "4	GLU	A	PHI	-120	-30"       9   1     9   44   parsed_6k59   1   
          7   "4	GLU	A	PSI	-120	120"      10   1    10   44   parsed_6k59   1   
          8   "5	GLN	A	PHI	-120	-30"      11   1    11   44   parsed_6k59   1   
          9   "5	GLN	A	PSI	-120	120"      12   1    12   44   parsed_6k59   1   
         10   "6	CYS	A	PHI	-120	-30"      13   1    13   44   parsed_6k59   1   
         11   "6	CYS	A	PSI	-120	120"      14   1    14   44   parsed_6k59   1   
         12   "7	CYS	A	PHI	-120	-30"      15   1    15   44   parsed_6k59   1   
         13   "7	CYS	A	PSI	-120	120"      16   1    16   44   parsed_6k59   1   
         14   "8	THR	A	PHI	-120	-30"      17   1    17   44   parsed_6k59   1   
         15   "8	THR	A	PSI	-120	120"      18   1    18   44   parsed_6k59   1   
         16   "9	SER	A	PHI	-120	-30"      19   1    19   44   parsed_6k59   1   
         17   "9	SER	A	PSI	-120	120"      20   1    20   44   parsed_6k59   1   
         18   "10	ILE	A	PHI	-120	-30"     21   1    21   44   parsed_6k59   1   
         19   "10	ILE	A	PSI	-120	120"     22   1    22   44   parsed_6k59   1   
         20   "11	CYS	A	PHI	-120	-30"     23   1    23   44   parsed_6k59   1   
         21   "11	CYS	A	PSI	-120	120"     24   1    24   44   parsed_6k59   1   
         22   "12	SER	A	PHI	-120	-30"     25   1    25   44   parsed_6k59   1   
         23   "12	SER	A	PSI	-120	120"     26   1    26   44   parsed_6k59   1   
         24   "13	LEU	A	PHI	-120	-30"     27   1    27   44   parsed_6k59   1   
         25   "13	LEU	A	PSI	-120	120"     28   1    28   44   parsed_6k59   1   
         26   "14	TYR	A	PHI	-120	-30"     29   1    29   44   parsed_6k59   1   
         27   "14	TYR	A	PSI	-120	120"     30   1    30   44   parsed_6k59   1   
         28   "15	GLN	A	PHI	-120	-30"     31   1    31   44   parsed_6k59   1   
         29   "15	GLN	A	PSI	-120	120"     32   1    32   44   parsed_6k59   1   
         30   "16	LEU	A	PHI	-120	-30"     33   1    33   44   parsed_6k59   1   
         31   "16	LEU	A	PSI	-120	120"     34   1    34   44   parsed_6k59   1   
         32   "17	GLU	A	PHI	-120	-30"     35   1    35   44   parsed_6k59   1   
         33   "17	GLU	A	PSI	-120	120"     36   1    36   44   parsed_6k59   1   
         34   "18	ASN	A	PHI	-120	-30"     37   1    37   44   parsed_6k59   1   
         35   "18	ASN	A	PSI	-120	120"     38   1    38   44   parsed_6k59   1   
         36   "19	TYR	A	PHI	-120	-30"     39   1    39   44   parsed_6k59   1   
         37   "19	TYR	A	PSI	-120	120"     40   1    40   44   parsed_6k59   1   
         38   "20	CYS	A	PHI	-120	-30"     41   1    41   44   parsed_6k59   1   
         39   "20	CYS	A	PSI	-120	120"     42   1    42   44   parsed_6k59   1   
         40   "21	GLY	A	PHI	-120	-30"     43   1    43   44   parsed_6k59   1   
         41   "1	PHE	B	PSI	-120	120"      44   1    44   44   parsed_6k59   1   
         42   "2	VAL	B	PHI	-120	-30"      45   1    45   44   parsed_6k59   1   
         43   "2	VAL	B	PSI	-120	120"      46   1    46   44   parsed_6k59   1   
         44   "3	ASN	B	PHI	-120	-30"      47   1    47   44   parsed_6k59   1   
         45   "3	ASN	B	PSI	-120	120"      48   1    48   44   parsed_6k59   1   
         46   "4	GLN	B	PHI	-120	-30"      49   1    49   44   parsed_6k59   1   
         47   "4	GLN	B	PSI	-120	120"      50   1    50   44   parsed_6k59   1   
         48   "5	HIS	B	PHI	-120	-30"      51   1    51   44   parsed_6k59   1   
         49   "5	HIS	B	PSI	-120	120"      52   1    52   44   parsed_6k59   1   
         50   "6	LEU	B	PHI	-120	-30"      53   1    53   44   parsed_6k59   1   
         51   "6	LEU	B	PSI	-120	120"      54   1    54   44   parsed_6k59   1   
         52   "7	CYS	B	PHI	-120	-30"      55   1    55   44   parsed_6k59   1   
         53   "7	CYS	B	PSI	-120	120"      56   1    56   44   parsed_6k59   1   
         54   "8	GLY	B	PHI	-120	-30"      57   1    57   44   parsed_6k59   1   
         55   "8	GLY	B	PSI	-120	120"      58   1    58   44   parsed_6k59   1   
         56   "9	SER	B	PHI	-120	-30"      59   1    59   44   parsed_6k59   1   
         57   "9	SER	B	PSI	-120	120"      60   1    60   44   parsed_6k59   1   
         58   "10	HIS	B	PHI	-120	-30"     61   1    61   44   parsed_6k59   1   
         59   "10	HIS	B	PSI	-120	120"     62   1    62   44   parsed_6k59   1   
         60   "11	LEU	B	PHI	-120	-30"     63   1    63   44   parsed_6k59   1   
         61   "11	LEU	B	PSI	-120	120"     64   1    64   44   parsed_6k59   1   
         62   "12	VAL	B	PHI	-120	-30"     65   1    65   44   parsed_6k59   1   
         63   "12	VAL	B	PSI	-120	120"     66   1    66   44   parsed_6k59   1   
         64   "13	GLU	B	PHI	-120	-30"     67   1    67   44   parsed_6k59   1   
         65   "13	GLU	B	PSI	-120	120"     68   1    68   44   parsed_6k59   1   
         66   "14	ALA	B	PHI	-120	-30"     69   1    69   44   parsed_6k59   1   
         67   "14	ALA	B	PSI	-120	120"     70   1    70   44   parsed_6k59   1   
         68   "15	LEU	B	PHI	-120	-30"     71   1    71   44   parsed_6k59   1   
         69   "15	LEU	B	PSI	-120	120"     72   1    72   44   parsed_6k59   1   
         70   "16	TYR	B	PHI	-120	-30"     73   1    73   44   parsed_6k59   1   
         71   "16	TYR	B	PSI	-120	120"     74   1    74   44   parsed_6k59   1   
         72   "17	LEU	B	PHI	-120	-30"     75   1    75   44   parsed_6k59   1   
         73   "17	LEU	B	PSI	-120	120"     76   1    76   44   parsed_6k59   1   
         74   "18	VAL	B	PHI	-120	-30"     77   1    77   44   parsed_6k59   1   
         75   "18	VAL	B	PSI	-120	120"     78   1    78   44   parsed_6k59   1   
         76   "19	CYS	B	PHI	-120	-30"     79   1    79   44   parsed_6k59   1   
         77   "19	CYS	B	PSI	-120	120"     80   1    80   44   parsed_6k59   1   
         78   "20	GLY	B	PHI	-120	-30"     81   1    81   44   parsed_6k59   1   
         79   "20	GLY	B	PSI	-120	120"     82   1    82   44   parsed_6k59   1   
         80   "21	GLU	B	PHI	-120	-30"     83   1    83   44   parsed_6k59   1   
         81   "21	GLU	B	PSI	-120	120"     84   1    84   44   parsed_6k59   1   
         82   "22	ARG	B	PHI	-120	-30"     85   1    85   44   parsed_6k59   1   
         83   "22	ARG	B	PSI	-120	120"     86   1    86   44   parsed_6k59   1   
         84   "23	GLY	B	PHI	-120	-30"     87   1    87   44   parsed_6k59   1   
         85   "23	GLY	B	PSI	-120	120"     88   1    88   44   parsed_6k59   1   
         86   "24	PHE	B	PHI	-120	-30"     89   1    89   44   parsed_6k59   1   
         87   "24	PHE	B	PSI	-120	120"     90   1    90   44   parsed_6k59   1   
         88   "25	PHE	B	PHI	-120	-30"     91   1    91   44   parsed_6k59   1   
         89   "25	PHE	B	PSI	-120	120"     92   1    92   44   parsed_6k59   1   
         90   "26	TYR	B	PHI	-120	-30"     93   1    93   44   parsed_6k59   1   
         91   "26	TYR	B	PSI	-120	120"     94   1    94   44   parsed_6k59   1   
         92   "27	THR	B	PHI	-120	-30"     95   1    95   44   parsed_6k59   1   
         93   "27	THR	B	PSI	-120	120"     96   1    96   44   parsed_6k59   1   
         94   "28	PRO	B	PHI	-120	-30"     97   1    97   44   parsed_6k59   1   
         95   "28	PRO	B	PSI	-120	120"     98   1    98   44   parsed_6k59   1   
         96   "29	LYS	B	PHI	-120	-30"     99   1    99   44   parsed_6k59   1   
         97   "29	LYS	B	PSI	-120	120"    100   1   100   44   parsed_6k59   1   
         98   "30	THR	B	PHI	-120	-30"    101   1   101   44   parsed_6k59   1   
         99   "30	THR	B	PSI	-120	120"    102   1   102   44   parsed_6k59   1   
        100   "31	ARG	B	PHI	-120	-30"    103   1   103   44   parsed_6k59   1   
        101   "31	ARG	B	PSI	-120	120"    104   1   104   44   parsed_6k59   1   
        102   
;
32	ARG	B	PHI	-120	-30
					
;
   105   1   106   41   parsed_6k59   1   
    stop_

save_





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