NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
34370 |
1ju7   |
5170 | cing | 2-parsed | STAR | dihedral angle | 67 |
data_1ju7_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1ju7
_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_1ju7 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1ju7
_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 1ju7 "Master copy" parsed_1ju7
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1ju7
_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 1ju7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1ju7 1
1 1ju7.mr . . XPLOR/CNS 2 distance NOE simple 265 parsed_1ju7 1
1 1ju7.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 34 parsed_1ju7 1
1 1ju7.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 67 parsed_1ju7 1
1 1ju7.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1ju7 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1ju7
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . HIST 9 . P HIST 9 . O5' HIST 9 . C5' HIST 9 . C4' parsed_1ju7 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . HIST 10 . P HIST 10 . O5' HIST 10 . C5' HIST 10 . C4' parsed_1ju7 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . HIST 11 . P HIST 11 . O5' HIST 11 . C5' HIST 11 . C4' parsed_1ju7 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . HIST 12 . P HIST 12 . O5' HIST 12 . C5' HIST 12 . C4' parsed_1ju7 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . HIST 13 . P HIST 13 . O5' HIST 13 . C5' HIST 13 . C4' parsed_1ju7 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.0 130.0 . HIST 15 . P HIST 15 . O5' HIST 15 . C5' HIST 15 . C4' parsed_1ju7 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.0 130.0 . HIST 16 . P HIST 16 . O5' HIST 16 . C5' HIST 16 . C4' parsed_1ju7 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.0 130.0 . HIST 17 . P HIST 17 . O5' HIST 17 . C5' HIST 17 . C4' parsed_1ju7 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . HIST 18 . P HIST 18 . O5' HIST 18 . C5' HIST 18 . C4' parsed_1ju7 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . HIST 19 . P HIST 19 . O5' HIST 19 . C5' HIST 19 . C4' parsed_1ju7 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . HIST 20 . P HIST 20 . O5' HIST 20 . C5' HIST 20 . C4' parsed_1ju7 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . HIST 21 . P HIST 21 . O5' HIST 21 . C5' HIST 21 . C4' parsed_1ju7 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . HIST 22 . P HIST 22 . O5' HIST 22 . C5' HIST 22 . C4' parsed_1ju7 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 330.0 . HIST 8 . C4' HIST 8 . C3' HIST 8 . O3' HIST 9 . P parsed_1ju7 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 345.0 . HIST 11 . C4' HIST 11 . C3' HIST 11 . O3' HIST 12 . P parsed_1ju7 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 340.0 . HIST 13 . C4' HIST 13 . C3' HIST 13 . O3' HIST 14 . P parsed_1ju7 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.0 350.0 . HIST 15 . C4' HIST 15 . C3' HIST 15 . O3' HIST 16 . P parsed_1ju7 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 345.0 . HIST 16 . C4' HIST 16 . C3' HIST 16 . O3' HIST 17 . P parsed_1ju7 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.0 350.0 . HIST 17 . C4' HIST 17 . C3' HIST 17 . O3' HIST 18 . P parsed_1ju7 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145.0 320.0 . HIST 18 . C4' HIST 18 . C3' HIST 18 . O3' HIST 19 . P parsed_1ju7 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145.0 320.0 . HIST 21 . C4' HIST 21 . C3' HIST 21 . O3' HIST 22 . P parsed_1ju7 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 8 . C5 HIST 8 . C6 HIST 8 . N1 HIST 23 . N3 parsed_1ju7 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 8 . C5 HIST 8 . C6 HIST 8 . O6 HIST 23 . N4 parsed_1ju7 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 9 . C5 HIST 9 . C6 HIST 9 . N1 HIST 22 . N3 parsed_1ju7 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 9 . C5 HIST 9 . C6 HIST 9 . O6 HIST 22 . N4 parsed_1ju7 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 21 . C5 HIST 21 . C6 HIST 21 . N1 HIST 10 . N3 parsed_1ju7 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 21 . C5 HIST 21 . C6 HIST 21 . O6 HIST 10 . N4 parsed_1ju7 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 20 . C5 HIST 20 . C6 HIST 20 . N1 HIST 11 . N3 parsed_1ju7 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 20 . C5 HIST 20 . C6 HIST 20 . O6 HIST 11 . N4 parsed_1ju7 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 19 . C5 HIST 19 . C6 HIST 19 . N1 HIST 12 . N3 parsed_1ju7 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 19 . C5 HIST 19 . C6 HIST 19 . O6 HIST 12 . N4 parsed_1ju7 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 18 . C5 HIST 18 . C6 HIST 18 . N1 HIST 13 . N3 parsed_1ju7 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . HIST 18 . C5 HIST 18 . C6 HIST 18 . N6 HIST 13 . O4 parsed_1ju7 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 8 . C2' HIST 8 . C1' HIST 8 . O4' HIST 8 . C4' parsed_1ju7 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 8 . O4' HIST 8 . C4' HIST 8 . C3' HIST 8 . C2' parsed_1ju7 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 9 . C2' HIST 9 . C1' HIST 9 . O4' HIST 9 . C4' parsed_1ju7 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 9 . O4' HIST 9 . C4' HIST 9 . C3' HIST 9 . C2' parsed_1ju7 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 10 . C2' HIST 10 . C1' HIST 10 . O4' HIST 10 . C4' parsed_1ju7 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 10 . O4' HIST 10 . C4' HIST 10 . C3' HIST 10 . C2' parsed_1ju7 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 11 . C2' HIST 11 . C1' HIST 11 . O4' HIST 11 . C4' parsed_1ju7 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 11 . O4' HIST 11 . C4' HIST 11 . C3' HIST 11 . C2' parsed_1ju7 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 12 . C2' HIST 12 . C1' HIST 12 . O4' HIST 12 . C4' parsed_1ju7 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 12 . O4' HIST 12 . C4' HIST 12 . C3' HIST 12 . C2' parsed_1ju7 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 13 . C2' HIST 13 . C1' HIST 13 . O4' HIST 13 . C4' parsed_1ju7 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 13 . O4' HIST 13 . C4' HIST 13 . C3' HIST 13 . C2' parsed_1ju7 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 18 . C2' HIST 18 . C1' HIST 18 . O4' HIST 18 . C4' parsed_1ju7 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 18 . O4' HIST 18 . C4' HIST 18 . C3' HIST 18 . C2' parsed_1ju7 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 19 . C2' HIST 19 . C1' HIST 19 . O4' HIST 19 . C4' parsed_1ju7 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 19 . O4' HIST 19 . C4' HIST 19 . C3' HIST 19 . C2' parsed_1ju7 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 20 . C2' HIST 20 . C1' HIST 20 . O4' HIST 20 . C4' parsed_1ju7 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 20 . O4' HIST 20 . C4' HIST 20 . C3' HIST 20 . C2' parsed_1ju7 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 21 . C2' HIST 21 . C1' HIST 21 . O4' HIST 21 . C4' parsed_1ju7 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 21 . O4' HIST 21 . C4' HIST 21 . C3' HIST 21 . C2' parsed_1ju7 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 22 . C2' HIST 22 . C1' HIST 22 . O4' HIST 22 . C4' parsed_1ju7 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 22 . O4' HIST 22 . C4' HIST 22 . C3' HIST 22 . C2' parsed_1ju7 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.4 4.4 . HIST 23 . C2' HIST 23 . C1' HIST 23 . O4' HIST 23 . C4' parsed_1ju7 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 321.5 326.5 . HIST 23 . O4' HIST 23 . C4' HIST 23 . C3' HIST 23 . C2' parsed_1ju7 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . HIST 9 . O5' HIST 9 . C5' HIST 9 . C4' HIST 9 . C3' parsed_1ju7 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . HIST 10 . O5' HIST 10 . C5' HIST 10 . C4' HIST 10 . C3' parsed_1ju7 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . HIST 11 . O5' HIST 11 . C5' HIST 11 . C4' HIST 11 . C3' parsed_1ju7 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . HIST 12 . O5' HIST 12 . C5' HIST 12 . C4' HIST 12 . C3' parsed_1ju7 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . HIST 13 . O5' HIST 13 . C5' HIST 13 . C4' HIST 13 . C3' parsed_1ju7 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . HIST 19 . O5' HIST 19 . C5' HIST 19 . C4' HIST 19 . C3' parsed_1ju7 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . HIST 20 . O5' HIST 20 . C5' HIST 20 . C4' HIST 20 . C3' parsed_1ju7 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . HIST 21 . O5' HIST 21 . C5' HIST 21 . C4' HIST 21 . C3' parsed_1ju7 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . HIST 22 . O5' HIST 22 . C5' HIST 22 . C4' HIST 22 . C3' parsed_1ju7 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . HIST 23 . O5' HIST 23 . C5' HIST 23 . C4' HIST 23 . C3' parsed_1ju7 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 "Beta Torsion angle constraints" 1 1 1 34 parsed_1ju7 1
2 "Epsilon Torsion angle constraints" 55 1 55 37 parsed_1ju7 1
3 "Planarity Constraints for Base Pairs" 89 1 89 38 parsed_1ju7 1
4
;
Torsion angle constraints about delta and nu 0
Sugar Pucker COnstraints
;
139 1 140 27 parsed_1ju7 1
5
;
Gamma Torsion angle constraints
A-form constraints for the stem
;
238 1 240 2 parsed_1ju7 1
stop_
save_
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