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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|
612844 |
2nct   |
26035 | cing | 2-parsed | STAR | dihedral angle |
data_2nct_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2nct
_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_2nct 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2nct
_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 2nct "Master copy" parsed_2nct
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2nct
_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 2nct.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2nct 1
1 2nct.mr . . DYANA/DIANA 2 distance NOE simple 361 parsed_2nct 1
1 2nct.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2nct 1
1 2nct.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2nct 1
stop_
save_
save_DYANA/DIANA_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2nct
_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 "Phi/Psi Angles From 'Strong' TALOS-N Predictions:" 1 1 1 52 parsed_2nct 1
2 "error margins are set to conservative default values of double the" 2 1 2 72 parsed_2nct 1
3 "standard deviation observed in TALOS-N capped at a minimum of +/-20 degree." 3 1 3 80 parsed_2nct 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 -84,9 -44,9" 4 4 4 34 parsed_2nct 1
2 "6 LYS PSI -49,5 -9,5" 5 4 5 34 parsed_2nct 1
3 "7 TRP PHI -85,4 -45,4" 6 4 6 34 parsed_2nct 1
4 "7 TRP PSI -57,8 -17,8" 7 4 7 34 parsed_2nct 1
5 "8 ALA PHI -87,4 -47,4" 8 4 8 34 parsed_2nct 1
6 "8 ALA PSI -56,6 -16,6" 9 4 9 34 parsed_2nct 1
7 "9 SER PHI -87,0 -47,0" 10 4 10 34 parsed_2nct 1
8 "9 SER PSI -56,2 -16,2" 11 4 11 34 parsed_2nct 1
9 "10 LEU PHI -87,5 -47,5" 12 3 12 34 parsed_2nct 1
10 "10 LEU PSI -61,1 -21,1" 13 3 13 34 parsed_2nct 1
11 "11 TRP PHI -86,5 -46,5" 14 3 14 34 parsed_2nct 1
12 "11 TRP PSI -56,7 -16,7" 15 3 15 34 parsed_2nct 1
13 "12 ASN PHI -86,0 -46,0" 16 3 16 34 parsed_2nct 1
14 "12 ASN PSI -57,9 -17,9" 17 3 17 34 parsed_2nct 1
15 "13 TRP PHI -84,8 -44,8" 18 3 18 34 parsed_2nct 1
16 "13 TRP PSI -62,6 -22,6" 19 3 19 34 parsed_2nct 1
17 "14 PHE PHI -86,2 -46,2" 20 3 20 34 parsed_2nct 1
18 "14 PHE PSI -58,4 -18,4" 21 3 21 34 parsed_2nct 1
19 "15 ASP PHI -87,5 -47,5" 22 3 22 34 parsed_2nct 1
20 "15 ASP PSI -56,7 -16,7" 23 3 23 34 parsed_2nct 1
21 "16 ILE PHI -87,2 -47,2" 24 3 24 34 parsed_2nct 1
22 "16 ILE PSI -61,8 -21,8" 25 3 25 34 parsed_2nct 1
23 "17 THR PHI -84,0 -44,0" 26 3 26 34 parsed_2nct 1
24 "17 THR PSI -58,0 -18,0" 27 3 27 34 parsed_2nct 1
25 "18 ASN PHI -85,3 -45,3" 28 3 28 34 parsed_2nct 1
26 "18 ASN PSI -58,7 -18,7" 29 3 29 34 parsed_2nct 1
27 "19 TRP PHI -84,8 -44,8" 30 3 30 34 parsed_2nct 1
28 "19 TRP PSI -64,8 -24,8" 31 3 31 34 parsed_2nct 1
29 "20 LEU PHI -86,3 -46,3" 32 3 32 34 parsed_2nct 1
30 "20 LEU PSI -58,9 -18,9" 33 3 33 34 parsed_2nct 1
31 "21 TRP PHI -82,5 -42,5" 34 3 34 34 parsed_2nct 1
32 "21 TRP PSI -65,5 -25,5" 35 3 35 34 parsed_2nct 1
33 "22 TYR PHI -84,5 -44,5" 36 3 36 34 parsed_2nct 1
34 "22 TYR PSI -63,5 -23,5" 37 3 37 34 parsed_2nct 1
35 "23 ILE PHI -85,3 -45,3" 38 3 38 34 parsed_2nct 1
36 "23 ILE PSI -57,6 -17,6" 39 3 39 34 parsed_2nct 1
37 "24 LYS PHI -84,8 -44,8" 40 3 40 34 parsed_2nct 1
38 "24 LYS PSI -59,6 -19,6" 41 3 41 34 parsed_2nct 1
39 "25 LEU PHI -84,9 -44,9" 42 3 42 34 parsed_2nct 1
40 "25 LEU PSI -63,9 -23,9" 43 3 43 34 parsed_2nct 1
41 "26 PHE PHI -83,3 -43,3" 44 3 44 34 parsed_2nct 1
42 "26 PHE PSI -63,5 -23,5" 45 3 45 34 parsed_2nct 1
43 "27 ILE PHI -83,6 -43,6" 46 3 46 34 parsed_2nct 1
44 "27 ILE PSI -62,2 -22,2" 47 3 47 34 parsed_2nct 1
45 "28 MET PHI -84,7 -44,7" 48 3 48 34 parsed_2nct 1
46 "28 MET PSI -63,4 -23,4" 49 3 49 34 parsed_2nct 1
47 "29 ILE PHI -83,1 -43,1" 50 3 50 34 parsed_2nct 1
48 "29 ILE PSI -63,9 -23,9" 51 3 51 34 parsed_2nct 1
49 "30 VAL PHI -84,5 -44,5" 52 3 52 34 parsed_2nct 1
50 "30 VAL PSI -62,5 -22,5" 53 3 53 34 parsed_2nct 1
51 "31 GLY PHI -84,8 -44,8" 54 3 54 34 parsed_2nct 1
52 "31 GLY PSI -61,7 -21,7" 55 3 55 34 parsed_2nct 1
53 "32 LYS PHI -87,5 -47,5" 56 3 56 34 parsed_2nct 1
54 "32 LYS PSI -58,6 -18,6" 57 3 57 34 parsed_2nct 1
55 "33 LYS PHI -89,1 -49,1" 58 3 58 34 parsed_2nct 1
56 "33 LYS PSI -53,8 -13,8" 59 3 59 34 parsed_2nct 1
57 "34 LYS PHI -91,3 -51,3" 60 3 60 34 parsed_2nct 1
58
;
34 LYS PSI -45,4 -5,4
# 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.
;
61 3 65 71 parsed_2nct 1
stop_
save_
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