Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
53540 | 2rnb RC | 11020 | cing | 2-parsed | STAR | dihedral angle | 56 |
data_2rnb_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2rnb
_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_2rnb 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2rnb
_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 2rnb "Master copy" parsed_2rnb
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2rnb
_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 2rnb.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2rnb 1
1 2rnb.mr . . DYANA/DIANA 2 distance NOE simple 836 parsed_2rnb 1
1 2rnb.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 56 parsed_2rnb 1
1 2rnb.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2rnb 1
stop_
save_
save_DYANA/DIANA_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2rnb
_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_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.8 -38.9 . . 14 ALA . . . . . . . . . . . . . parsed_2rnb 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 91.0 201.4 . . 14 ALA . . . . . . . . . . . . . parsed_2rnb 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.2 -51.0 . . 22 LYS . . . . . . . . . . . . . parsed_2rnb 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85.1 192.3 . . 22 LYS . . . . . . . . . . . . . parsed_2rnb 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.0 -67.0 . . 27 CYS . . . . . . . . . . . . . parsed_2rnb 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.0 -3.0 . . 27 CYS . . . . . . . . . . . . . parsed_2rnb 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111.0 -75.0 . . 28 CYS . . . . . . . . . . . . . parsed_2rnb 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -37.0 15.0 . . 28 CYS . . . . . . . . . . . . . parsed_2rnb 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.6 -51.3 . . 32 GLU . . . . . . . . . . . . . parsed_2rnb 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.0 -22.6 . . 32 GLU . . . . . . . . . . . . . parsed_2rnb 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.6 -52.9 . . 33 THR . . . . . . . . . . . . . parsed_2rnb 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.5 -13.4 . . 33 THR . . . . . . . . . . . . . parsed_2rnb 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.8 -50.8 . . 34 LYS . . . . . . . . . . . . . parsed_2rnb 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.7 -32.2 . . 34 LYS . . . . . . . . . . . . . parsed_2rnb 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.4 -52.4 . . 35 LYS . . . . . . . . . . . . . parsed_2rnb 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.0 -12.8 . . 35 LYS . . . . . . . . . . . . . parsed_2rnb 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.4 -50.3 . . 37 ARG . . . . . . . . . . . . . parsed_2rnb 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.5 -27.4 . . 37 ARG . . . . . . . . . . . . . parsed_2rnb 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.1 -50.2 . . 38 ASP . . . . . . . . . . . . . parsed_2rnb 1
20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.3 -25.9 . . 38 ASP . . . . . . . . . . . . . parsed_2rnb 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.3 -56.0 . . 39 ALA . . . . . . . . . . . . . parsed_2rnb 1
22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.8 -27.5 . . 39 ALA . . . . . . . . . . . . . parsed_2rnb 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.5 -51.2 . . 40 CYSS . . . . . . . . . . . . . parsed_2rnb 1
24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.7 -34.7 . . 40 CYSS . . . . . . . . . . . . . parsed_2rnb 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 -55.0 . . 41 ILE . . . . . . . . . . . . . parsed_2rnb 1
26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.6 -26.6 . . 41 ILE . . . . . . . . . . . . . parsed_2rnb 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.6 -52.5 . . 42 ILE . . . . . . . . . . . . . parsed_2rnb 1
28 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.4 -13.5 . . 42 ILE . . . . . . . . . . . . . parsed_2rnb 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -99.5 -42.8 . . 43 GLU . . . . . . . . . . . . . parsed_2rnb 1
30 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.2 -10.3 . . 43 GLU . . . . . . . . . . . . . parsed_2rnb 1
31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.8 -46.9 . . 46 GLU . . . . . . . . . . . . . parsed_2rnb 1
32 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.8 -22.1 . . 46 GLU . . . . . . . . . . . . . parsed_2rnb 1
33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.3 -53.5 . . 51 HIS . . . . . . . . . . . . . parsed_2rnb 1
34 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.4 -26.0 . . 51 HIS . . . . . . . . . . . . . parsed_2rnb 1
35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.2 -55.2 . . 52 LEU . . . . . . . . . . . . . parsed_2rnb 1
36 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.3 -27.9 . . 52 LEU . . . . . . . . . . . . . parsed_2rnb 1
37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.9 -52.9 . . 53 ILE . . . . . . . . . . . . . parsed_2rnb 1
38 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.8 -33.8 . . 53 ILE . . . . . . . . . . . . . parsed_2rnb 1
39 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.3 -54.3 . . 54 GLU . . . . . . . . . . . . . parsed_2rnb 1
40 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.3 -27.6 . . 54 GLU . . . . . . . . . . . . . parsed_2rnb 1
41 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.8 -48.9 . . 55 ALA . . . . . . . . . . . . . parsed_2rnb 1
42 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.0 -27.2 . . 55 ALA . . . . . . . . . . . . . parsed_2rnb 1
43 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.7 -53.7 . . 56 HIS . . . . . . . . . . . . . parsed_2rnb 1
44 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.2 -31.3 . . 56 HIS . . . . . . . . . . . . . parsed_2rnb 1
45 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.0 -49.4 . . 57 LYS . . . . . . . . . . . . . parsed_2rnb 1
46 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.3 -30.4 . . 57 LYS . . . . . . . . . . . . . parsed_2rnb 1
47 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.0 -49.1 . . 58 GLU . . . . . . . . . . . . . parsed_2rnb 1
48 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.3 -12.4 . . 58 GLU . . . . . . . . . . . . . parsed_2rnb 1
49 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.2 -48.4 . . 60 MET . . . . . . . . . . . . . parsed_2rnb 1
50 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.4 -11.6 . . 60 MET . . . . . . . . . . . . . parsed_2rnb 1
51 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.7 -47.5 . . 61 ARG . . . . . . . . . . . . . parsed_2rnb 1
52 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.6 -19.3 . . 61 ARG . . . . . . . . . . . . . parsed_2rnb 1
53 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.9 -50.6 . . 62 ALA . . . . . . . . . . . . . parsed_2rnb 1
54 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.6 -9.5 . . 62 ALA . . . . . . . . . . . . . parsed_2rnb 1
55 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.4 -51.1 . . 65 PHE . . . . . . . . . . . . . parsed_2rnb 1
56 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.6 158.3 . . 65 PHE . . . . . . . . . . . . . parsed_2rnb 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
;
ssbond 40-49
ssbond 30-59
;
57 1 58 12 parsed_2rnb 1
stop_
save_