Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
623063 | 5nww RC | 34134 | cing | 2-parsed | STAR | dihedral angle | 57 |
data_5nww_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5nww
_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_5nww 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5nww
_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 5nww "Master copy" parsed_5nww
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5nww
_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 5nww.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5nww 1
1 5nww.mr . . DYANA/DIANA 2 "dihedral angle" "Not applicable" "Not applicable" 57 parsed_5nww 1
1 5nww.mr . . DYANA/DIANA 3 distance NOE simple 0 parsed_5nww 1
1 5nww.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5nww 1
stop_
save_
save_DYANA/DIANA_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_5nww
_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_
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 2 ILE . . . . . . . . . . . . . parsed_5nww 1
2 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 3 GLY . . . . . . . . . . . . . parsed_5nww 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 4 ALA . . . . . . . . . . . . . parsed_5nww 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 0.0 . . 4 ALA . . . . . . . . . . . . . parsed_5nww 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 5 PHE . . . . . . . . . . . . . parsed_5nww 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 0.0 . . 5 PHE . . . . . . . . . . . . . parsed_5nww 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 6 GLY . . . . . . . . . . . . . parsed_5nww 1
8 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 7 LEU . . . . . . . . . . . . . parsed_5nww 1
9 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 0.0 . . 7 LEU . . . . . . . . . . . . . parsed_5nww 1
10 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.6 -45.4 . . 8 LEU . . . . . . . . . . . . . parsed_5nww 1
11 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.2 0.3 . . 8 LEU . . . . . . . . . . . . . parsed_5nww 1
12 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 9 GLY . . . . . . . . . . . . . parsed_5nww 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.5 -52.8 . . 10 PHE . . . . . . . . . . . . . parsed_5nww 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.8 -0.1 . . 10 PHE . . . . . . . . . . . . . parsed_5nww 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.5 -48.9 . . 11 LEU . . . . . . . . . . . . . parsed_5nww 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.1 -28.1 . . 11 LEU . . . . . . . . . . . . . parsed_5nww 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.8 -49.2 . . 12 ALA . . . . . . . . . . . . . parsed_5nww 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.0 -27.6 . . 12 ALA . . . . . . . . . . . . . parsed_5nww 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -103.5 -55.1 . . 13 ALA . . . . . . . . . . . . . parsed_5nww 1
20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.5 17.9 . . 13 ALA . . . . . . . . . . . . . parsed_5nww 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.6 -46.3 . . 14 GLY . . . . . . . . . . . . . parsed_5nww 1
22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.2 -32.1 . . 14 GLY . . . . . . . . . . . . . parsed_5nww 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -114.3 -56.5 . . 15 SER . . . . . . . . . . . . . parsed_5nww 1
24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.5 29.4 . . 15 SER . . . . . . . . . . . . . parsed_5nww 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.2 -54.1 . . 16 LYS . . . . . . . . . . . . . parsed_5nww 1
26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.4 -16.2 . . 16 LYS . . . . . . . . . . . . . parsed_5nww 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 17 LYS . . . . . . . . . . . . . parsed_5nww 1
28 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 19 LYS . . . . . . . . . . . . . parsed_5nww 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.2 -38.0 . . 20 ASN . . . . . . . . . . . . . parsed_5nww 1
30 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.7 -49.1 . . 21 GLU . . . . . . . . . . . . . parsed_5nww 1
31 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.6 -18.0 . . 21 GLU . . . . . . . . . . . . . parsed_5nww 1
32 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.3 -25.1 . . 22 GLN . . . . . . . . . . . . . parsed_5nww 1
33 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.4 0.6 . . 22 GLN . . . . . . . . . . . . . parsed_5nww 1
34 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.6 -34.1 . . 23 GLU . . . . . . . . . . . . . parsed_5nww 1
35 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.4 -33.4 . . 23 GLU . . . . . . . . . . . . . parsed_5nww 1
36 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91.9 -35.0 . . 24 LEU . . . . . . . . . . . . . parsed_5nww 1
37 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.7 5.6 . . 24 LEU . . . . . . . . . . . . . parsed_5nww 1
38 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -106.9 -38.2 . . 25 LEU . . . . . . . . . . . . . parsed_5nww 1
39 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.5 30.2 . . 25 LEU . . . . . . . . . . . . . parsed_5nww 1
40 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91.4 -55.2 . . 26 GLU . . . . . . . . . . . . . parsed_5nww 1
41 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.2 3.2 . . 26 GLU . . . . . . . . . . . . . parsed_5nww 1
42 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.1 -50.5 . . 27 LEU . . . . . . . . . . . . . parsed_5nww 1
43 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.8 2.3 . . 27 LEU . . . . . . . . . . . . . parsed_5nww 1
44 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.4 -55.4 . . 28 ASP . . . . . . . . . . . . . parsed_5nww 1
45 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.5 -5.5 . . 28 ASP . . . . . . . . . . . . . parsed_5nww 1
46 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.2 -47.2 . . 29 LYS . . . . . . . . . . . . . parsed_5nww 1
47 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.4 -1.1 . . 29 LYS . . . . . . . . . . . . . parsed_5nww 1
48 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.7 -18.5 . . 30 TRP . . . . . . . . . . . . . parsed_5nww 1
49 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.8 0.3 . . 30 TRP . . . . . . . . . . . . . parsed_5nww 1
50 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.3 -47.4 . . 31 ALA . . . . . . . . . . . . . parsed_5nww 1
51 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.1 -15.5 . . 31 ALA . . . . . . . . . . . . . parsed_5nww 1
52 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.0 -27.0 . . 32 SER . . . . . . . . . . . . . parsed_5nww 1
53 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.3 -4.2 . . 32 SER . . . . . . . . . . . . . parsed_5nww 1
54 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.3 -34.8 . . 33 LEU . . . . . . . . . . . . . parsed_5nww 1
55 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.8 -19.7 . . 33 LEU . . . . . . . . . . . . . parsed_5nww 1
56 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.7 -34.6 . . 34 TRP . . . . . . . . . . . . . parsed_5nww 1
57 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.1 -6.0 . . 34 TRP . . . . . . . . . . . . . parsed_5nww 1
stop_
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 1: Scr20DPC.aco" 1 1 1 33 parsed_5nww 1
stop_
save_