NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type |
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650854 |
6t33   |
50027 | cing | 2-parsed | STAR | dihedral angle |
data_6t33_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6t33
_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_6t33 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6t33
_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 6t33 "Master copy" parsed_6t33
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6t33
_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 6t33.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6t33 1
1 6t33.mr . . DYANA/DIANA 2 distance "hydrogen bond" simple 50 parsed_6t33 1
1 6t33.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_6t33 1
1 6t33.mr . . DYANA/DIANA 4 distance "general distance" simple 0 parsed_6t33 1
1 6t33.mr . . DYANA/DIANA 5 distance NOE simple 0 parsed_6t33 1
1 6t33.mr . . DYANA/DIANA 6 distance "general distance" simple 0 parsed_6t33 1
1 6t33.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6t33 1
stop_
save_
save_DYANA/DIANA_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_6t33
_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: predtalos.aco" 1 1 1 34 parsed_6t33 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 "2 GLY PHI -203,4 -86,2" 2 4 2 34 parsed_6t33 1
2 "2 GLY PSI 88,1 222,0" 3 4 3 34 parsed_6t33 1
3 "3 CYSS PHI -155,0 -100,5" 4 4 4 34 parsed_6t33 1
4 "3 CYSS PSI 114,9 157,5" 5 4 5 34 parsed_6t33 1
5 "4 VAL PHI -167,1 -61,9" 6 4 6 34 parsed_6t33 1
6 "4 VAL PSI 106,2 171,2" 7 4 7 34 parsed_6t33 1
7 "5 CYSS PHI -158,0 -109,4" 8 4 8 35 parsed_6t33 1
8 "5 CYSS PSI 118,0 179,6" 9 4 9 35 parsed_6t33 1
9 "8 SER PHI -147,0 -27,4" 10 4 10 34 parsed_6t33 1
10 "8 SER PSI 93,9 184,0" 11 4 11 34 parsed_6t33 1
11 "9 THR PHI -79,0 -39,0" 12 4 12 34 parsed_6t33 1
12 "9 THR PSI -72,9 -10,0" 13 4 13 34 parsed_6t33 1
13 "10 ALA PHI -79,2 -39,2" 14 3 14 34 parsed_6t33 1
14 "10 ALA PSI -65,0 -22,0" 15 3 15 34 parsed_6t33 1
15 "11 VAL PHI -84,3 -44,3" 16 3 16 34 parsed_6t33 1
16 "11 VAL PSI -60,7 -20,7" 17 3 17 34 parsed_6t33 1
17 "13 ASN PHI -81,9 -41,9" 18 3 18 34 parsed_6t33 1
18 "13 ASN PSI -58,9 -18,9" 19 3 19 34 parsed_6t33 1
19 "14 SER PHI -87,1 -41,6" 20 3 20 34 parsed_6t33 1
20 "14 SER PSI -65,6 -25,6" 21 3 21 34 parsed_6t33 1
21 "20 ALA PHI -115,4 -53,9" 22 3 22 34 parsed_6t33 1
22 "20 ALA PSI -69,5 24,5" 23 3 23 34 parsed_6t33 1
23 "21 TYR PHI -165,4 -104,4" 24 3 24 34 parsed_6t33 1
24 "21 TYR PSI 134,4 174,4" 25 3 25 34 parsed_6t33 1
25 "22 CYSS PHI -186,6 -68,5" 26 3 26 35 parsed_6t33 1
26 "22 CYSS PSI 113,5 159,1" 27 3 27 35 parsed_6t33 1
27 "24 GLY PHI -162,8 -87,3" 28 3 28 34 parsed_6t33 1
28 "24 GLY PSI 96,1 166,3" 29 3 29 34 parsed_6t33 1
29 "25 TYR PHI -164,1 -42,2" 30 3 30 34 parsed_6t33 1
30 "25 TYR PSI 106,4 162,1" 31 3 31 34 parsed_6t33 1
31 "33 THR PHI -79,3 -39,3" 32 3 32 34 parsed_6t33 1
32 "35 ASN PHI -83,4 -43,4" 33 3 33 34 parsed_6t33 1
33 "35 ASN PSI -61,2 -21,2" 34 3 34 34 parsed_6t33 1
34 "36 ALA PHI -83,1 -43,1" 35 3 35 34 parsed_6t33 1
35 "36 ALA PSI -67,9 -27,9" 36 3 36 34 parsed_6t33 1
36 "37 ASN PHI -83,4 -43,4" 37 3 37 34 parsed_6t33 1
37 "37 ASN PSI -61,8 -21,8" 38 3 38 34 parsed_6t33 1
38 "38 ALA PHI -79,5 -39,5" 39 3 39 34 parsed_6t33 1
39 "38 ALA PSI -66,4 -20,5" 40 3 40 34 parsed_6t33 1
40 "39 ASN PHI -79,3 -39,3" 41 3 41 34 parsed_6t33 1
41 "39 ASN PSI -65,6 -20,4" 42 3 42 34 parsed_6t33 1
42 "40 VAL PHI -78,3 -38,3" 43 3 43 34 parsed_6t33 1
43 "40 VAL PSI -65,9 -25,9" 44 3 44 34 parsed_6t33 1
44 "41 ALA PHI -85,9 -45,9" 45 3 45 34 parsed_6t33 1
45 "41 ALA PSI -52,4 -12,4" 46 3 46 34 parsed_6t33 1
46 "44 ALA PHI -83,4 -43,4" 47 3 47 34 parsed_6t33 1
stop_
save_
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