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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|
612835 |
2ncs   |
26034 | cing | 2-parsed | STAR | dihedral angle |
data_2ncs_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2ncs
_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_2ncs 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2ncs
_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 2ncs "Master copy" parsed_2ncs
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2ncs
_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 2ncs.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2ncs 1
1 2ncs.mr . . DYANA/DIANA 2 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2ncs 1
1 2ncs.mr . . DYANA/DIANA 3 distance NOE simple 0 parsed_2ncs 1
1 2ncs.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2ncs 1
stop_
save_
save_DYANA/DIANA_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2ncs
_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 "Phi/Psi Angles From 'Strong' TALOS-N Predictions:" 1 1 1 52 parsed_2ncs 1
2 "error margins are set to conservative default values of double the" 2 1 2 72 parsed_2ncs 1
3 "standard deviation observed in TALOS-N capped at a minimum of +/-20 degree." 3 1 3 80 parsed_2ncs 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 "6 LYS PHI -85,0 -45,0" 4 4 4 34 parsed_2ncs 1
2 "6 LYS PSI -51,8 -11,8" 5 4 5 34 parsed_2ncs 1
3 "7 TRP PHI -85,1 -45,1" 6 4 6 34 parsed_2ncs 1
4 "7 TRP PSI -58,2 -18,2" 7 4 7 34 parsed_2ncs 1
5 "8 ALA PHI -87,6 -47,6" 8 4 8 34 parsed_2ncs 1
6 "8 ALA PSI -57,3 -17,3" 9 4 9 34 parsed_2ncs 1
7 "9 SER PHI -88,5 -48,5" 10 4 10 34 parsed_2ncs 1
8 "9 SER PSI -55,9 -15,9" 11 4 11 34 parsed_2ncs 1
9 "10 LEU PHI -86,3 -46,3" 12 3 12 34 parsed_2ncs 1
10 "10 LEU PSI -62,2 -22,2" 13 3 13 34 parsed_2ncs 1
11 "11 TRP PHI -86,4 -46,4" 14 3 14 34 parsed_2ncs 1
12 "11 TRP PSI -54,8 -14,8" 15 3 15 34 parsed_2ncs 1
13 "12 ASN PHI -86,1 -46,1" 16 3 16 34 parsed_2ncs 1
14 "12 ASN PSI -56,2 -16,2" 17 3 17 34 parsed_2ncs 1
15 "13 TRP PHI -89,1 -49,1" 18 3 18 34 parsed_2ncs 1
16 "13 TRP PSI -57,8 -17,8" 19 3 19 34 parsed_2ncs 1
17 "14 PHE PHI -87,4 -47,4" 20 3 20 34 parsed_2ncs 1
18 "14 PHE PSI -59,3 -19,3" 21 3 21 34 parsed_2ncs 1
19 "15 ASP PHI -86,3 -46,3" 22 3 22 34 parsed_2ncs 1
20 "15 ASP PSI -58,4 -18,4" 23 3 23 34 parsed_2ncs 1
21 "16 ILE PHI -87,4 -47,4" 24 3 24 34 parsed_2ncs 1
22 "16 ILE PSI -59,1 -19,1" 25 3 25 34 parsed_2ncs 1
23 "17 THR PHI -85,0 -45,0" 26 3 26 34 parsed_2ncs 1
24 "17 THR PSI -57,2 -17,2" 27 3 27 34 parsed_2ncs 1
25 "18 ASN PHI -87,0 -47,0" 28 3 28 34 parsed_2ncs 1
26 "18 ASN PSI -56,7 -16,7" 29 3 29 34 parsed_2ncs 1
27 "19 TRP PHI -86,7 -46,7" 30 3 30 34 parsed_2ncs 1
28 "19 TRP PSI -62,5 -22,5" 31 3 31 34 parsed_2ncs 1
29 "20 LEU PHI -86,1 -46,1" 32 3 32 34 parsed_2ncs 1
30 "20 LEU PSI -60,2 -20,2" 33 3 33 34 parsed_2ncs 1
31 "21 TRP PHI -83,3 -43,3" 34 3 34 34 parsed_2ncs 1
32 "21 TRP PSI -64,1 -24,1" 35 3 35 34 parsed_2ncs 1
33 "22 TYR PHI -83,6 -43,6" 36 3 36 34 parsed_2ncs 1
34 "22 TYR PSI -64,9 -24,9" 37 3 37 34 parsed_2ncs 1
35 "23 ILE PHI -83,3 -43,3" 38 3 38 34 parsed_2ncs 1
36 "23 ILE PSI -60,7 -20,7" 39 3 39 34 parsed_2ncs 1
37 "24 LYS PHI -83,4 -43,4" 40 3 40 34 parsed_2ncs 1
38 "24 LYS PSI -61,2 -21,2" 41 3 41 34 parsed_2ncs 1
39 "25 LEU PHI -82,9 -42,9" 42 3 42 34 parsed_2ncs 1
40 "25 LEU PSI -63,8 -23,8" 43 3 43 34 parsed_2ncs 1
41 "26 PHE PHI -83,7 -43,7" 44 3 44 34 parsed_2ncs 1
42 "26 PHE PSI -62,6 -22,6" 45 3 45 34 parsed_2ncs 1
43 "27 ILE PHI -84,2 -44,2" 46 3 46 34 parsed_2ncs 1
44 "27 ILE PSI -61,1 -21,1" 47 3 47 34 parsed_2ncs 1
45 "28 MET PHI -86,2 -46,2" 48 3 48 34 parsed_2ncs 1
46 "28 MET PSI -61,3 -21,3" 49 3 49 34 parsed_2ncs 1
47 "29 ILE PHI -84,9 -44,9" 50 3 50 34 parsed_2ncs 1
48 "29 ILE PSI -64,7 -24,7" 51 3 51 34 parsed_2ncs 1
49 "30 VAL PHI -84,9 -44,9" 52 3 52 34 parsed_2ncs 1
50 "30 VAL PSI -59,0 -19,0" 53 3 53 34 parsed_2ncs 1
51 "31 GLY PHI -87,1 -47,1" 54 3 54 34 parsed_2ncs 1
52
;
31 GLY PSI -55,6 -8,0
# Phi/Psi Angles From 'Generous' TALOS-N Predictions:
# error margins are set to default values of triple the standard
# deviation observed in TALOS-N capped at a minimum of +/-30 degree.
;
55 3 59 72 parsed_2ncs 1
stop_
save_
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