Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
50408 | 2k0q RC | 15655 | cing | 2-parsed | STAR | dihedral angle | 58 |
data_2k0q_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k0q
_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_2k0q 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k0q
_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 2k0q "Master copy" parsed_2k0q
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k0q
_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 2k0q.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k0q 1
1 2k0q.mr . . unknown 2 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k0q 1
1 2k0q.mr . . XPLOR/CNS 3 distance NOE ambi 341 parsed_2k0q 1
1 2k0q.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 58 parsed_2k0q 1
1 2k0q.mr . . XPLOR/CNS 5 distance NOE simple 0 parsed_2k0q 1
1 2k0q.mr . . XPLOR/CNS 6 distance NOE simple 0 parsed_2k0q 1
1 2k0q.mr . . XPLOR/CNS 7 distance "hydrogen bond" simple 0 parsed_2k0q 1
1 2k0q.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k0q 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2k0q
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -167.0 -107.0 . . 7 . c . 8 . n . 8 . ca . 8 . c parsed_2k0q 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.0 166.0 . . 8 . n . 8 . ca . 8 . c . 9 . n parsed_2k0q 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -154.0 -94.0 . . 8 . c . 9 . n . 9 . ca . 9 . c parsed_2k0q 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.0 164.0 . . 9 . n . 9 . ca . 9 . c . 10 . n parsed_2k0q 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 -80.0 . . 9 . c . 10 . n . 10 . ca . 10 . c parsed_2k0q 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 93.0 153.0 . . 10 . n . 10 . ca . 10 . c . 11 . n parsed_2k0q 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 -105.0 . . 16 . c . 17 . n . 17 . ca . 17 . c parsed_2k0q 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128.0 188.0 . . 17 . n . 17 . ca . 17 . c . 18 . n parsed_2k0q 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 17 . c . 18 . n . 18 . ca . 18 . c parsed_2k0q 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.0 161.0 . . 18 . n . 18 . ca . 18 . c . 19 . n parsed_2k0q 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.0 -83.0 . . 18 . c . 19 . n . 19 . ca . 19 . c parsed_2k0q 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.0 164.0 . . 19 . n . 19 . ca . 19 . c . 20 . n parsed_2k0q 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.0 -79.0 . . 19 . c . 20 . n . 20 . ca . 20 . c parsed_2k0q 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 150.0 . . 20 . n . 20 . ca . 20 . c . 21 . n parsed_2k0q 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.0 -50.0 . . 20 . c . 21 . n . 21 . ca . 21 . c parsed_2k0q 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.0 186.0 . . 21 . n . 21 . ca . 21 . c . 22 . n parsed_2k0q 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.0 -33.0 . . 21 . c . 22 . n . 22 . ca . 22 . c parsed_2k0q 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.0 9.0 . . 22 . n . 22 . ca . 22 . c . 23 . n parsed_2k0q 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -95.0 . . 25 . c . 26 . n . 26 . ca . 26 . c parsed_2k0q 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.0 183.0 . . 26 . n . 26 . ca . 26 . c . 27 . n parsed_2k0q 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.0 -89.0 . . 27 . c . 28 . n . 28 . ca . 28 . c parsed_2k0q 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.0 163.0 . . 28 . n . 28 . ca . 28 . c . 29 . n parsed_2k0q 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.0 -101.0 . . 28 . c . 29 . n . 29 . ca . 29 . c parsed_2k0q 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 174.0 . . 29 . n . 29 . ca . 29 . c . 30 . n parsed_2k0q 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -114.0 -54.0 . . 29 . c . 30 . n . 30 . ca . 30 . c parsed_2k0q 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 129.0 189.0 . . 30 . n . 30 . ca . 30 . c . 31 . n parsed_2k0q 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.0 -32.0 . . 30 . c . 31 . n . 31 . ca . 31 . c parsed_2k0q 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.0 5.0 . . 31 . n . 31 . ca . 31 . c . 32 . n parsed_2k0q 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.0 -71.0 . . 41 . c . 42 . n . 42 . ca . 42 . c parsed_2k0q 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.0 163.0 . . 42 . n . 42 . ca . 42 . c . 43 . n parsed_2k0q 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -114.0 -54.0 . . 42 . c . 43 . n . 43 . ca . 43 . c parsed_2k0q 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99.0 159.0 . . 43 . n . 43 . ca . 43 . c . 44 . n parsed_2k0q 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -141.0 -81.0 . . 43 . c . 44 . n . 44 . ca . 44 . c parsed_2k0q 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 174.0 . . 44 . n . 44 . ca . 44 . c . 45 . n parsed_2k0q 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.0 -72.0 . . 44 . c . 45 . n . 45 . ca . 45 . c parsed_2k0q 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.0 168.0 . . 45 . n . 45 . ca . 45 . c . 46 . n parsed_2k0q 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.0 -67.0 . . 45 . c . 46 . n . 46 . ca . 46 . c parsed_2k0q 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 141.0 201.0 . . 46 . n . 46 . ca . 46 . c . 47 . n parsed_2k0q 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.0 -34.0 . . 46 . c . 47 . n . 47 . ca . 47 . c parsed_2k0q 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.0 11.0 . . 47 . n . 47 . ca . 47 . c . 48 . n parsed_2k0q 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.0 -64.0 . . 49 . c . 50 . n . 50 . ca . 50 . c parsed_2k0q 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.0 175.0 . . 50 . n . 50 . ca . 50 . c . 51 . n parsed_2k0q 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.0 -99.0 . . 50 . c . 51 . n . 51 . ca . 51 . c parsed_2k0q 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 129.0 189.0 . . 51 . n . 51 . ca . 51 . c . 52 . n parsed_2k0q 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -176.0 -116.0 . . 51 . c . 52 . n . 52 . ca . 52 . c parsed_2k0q 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.0 183.0 . . 52 . n . 52 . ca . 52 . c . 53 . n parsed_2k0q 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168.0 -108.0 . . 52 . c . 53 . n . 53 . ca . 53 . c parsed_2k0q 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.0 165.0 . . 53 . n . 53 . ca . 53 . c . 54 . n parsed_2k0q 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.0 -89.0 . . 53 . c . 54 . n . 54 . ca . 54 . c parsed_2k0q 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.0 162.0 . . 54 . n . 54 . ca . 54 . c . 55 . n parsed_2k0q 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.0 -84.0 . . 54 . c . 55 . n . 55 . ca . 55 . c parsed_2k0q 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 92.0 152.0 . . 55 . n . 55 . ca . 55 . c . 56 . n parsed_2k0q 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.0 -83.0 . . 58 . c . 59 . n . 59 . ca . 59 . c parsed_2k0q 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.0 163.0 . . 59 . n . 59 . ca . 59 . c . 60 . n parsed_2k0q 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.0 -85.0 . . 59 . c . 60 . n . 60 . ca . 60 . c parsed_2k0q 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.0 172.0 . . 60 . n . 60 . ca . 60 . c . 61 . n parsed_2k0q 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.0 -96.0 . . 60 . c . 61 . n . 61 . ca . 61 . c parsed_2k0q 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.0 166.0 . . 61 . n . 61 . ca . 61 . c . 62 . n parsed_2k0q 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 "message=off echo=off" 1 1 1 28 parsed_2k0q 1
2
;
!
!K-8
;
3 1 4 8 parsed_2k0q 1
3 !T-9 9 3 9 8 parsed_2k0q 1
4 !Y-10 14 3 14 9 parsed_2k0q 1
5 !K-17 19 3 19 9 parsed_2k0q 1
6 !V-18 24 3 24 9 parsed_2k0q 1
7 !H-19 29 3 29 9 parsed_2k0q 1
8 !V-20 34 3 34 9 parsed_2k0q 1
9 !F-21 39 3 39 9 parsed_2k0q 1
10 !K-22 44 3 44 9 parsed_2k0q 1
11 !M-26 49 3 49 9 parsed_2k0q 1
12 !M-28 54 3 54 9 parsed_2k0q 1
13 !E-29 59 3 59 9 parsed_2k0q 1
14 !N-30 64 3 64 9 parsed_2k0q 1
15 !K-31 69 3 69 9 parsed_2k0q 1
16 !K-42 74 3 74 9 parsed_2k0q 1
17 !V-43 79 3 79 9 parsed_2k0q 1
18 !M-44 84 3 84 9 parsed_2k0q 1
19 !E-45 89 3 89 9 parsed_2k0q 1
20 !T-46 94 3 94 9 parsed_2k0q 1
21 !R-47 99 3 99 9 parsed_2k0q 1
22 !T-50 104 3 104 9 parsed_2k0q 1
23 !K-51 109 3 109 9 parsed_2k0q 1
24 !I-52 114 3 114 9 parsed_2k0q 1
25 !I-53 119 3 119 9 parsed_2k0q 1
26 !M-54 124 3 124 9 parsed_2k0q 1
27 !K-55 129 3 129 9 parsed_2k0q 1
28 !I-59 134 3 134 9 parsed_2k0q 1
29 !F-60 139 3 139 9 parsed_2k0q 1
30 !R-61 144 3 144 9 parsed_2k0q 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 "restraints dihedral reset" 2 1 2 25 parsed_2k0q 1
2 end 149 1 149 3 parsed_2k0q 1
stop_
save_