NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
51274 |
2k65   |
15858 | cing | 2-parsed | STAR | dihedral angle | 62 |
data_2k65_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k65
_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_2k65 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k65
_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 2k65 "Master copy" parsed_2k65
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k65
_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 2k65.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k65 1
1 2k65.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_2k65 1
1 2k65.mr . . XPLOR/CNS 3 distance NOE simple 221 parsed_2k65 1
1 2k65.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_2k65 1
1 2k65.mr . . XPLOR/CNS 5 distance NOE simple 60 parsed_2k65 1
1 2k65.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_2k65 1
1 2k65.mr . . XPLOR/CNS 7 distance NOE simple 37 parsed_2k65 1
1 2k65.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_2k65 1
1 2k65.mr . . XPLOR/CNS 9 "dihedral angle" "Not applicable" "Not applicable" 62 parsed_2k65 1
1 2k65.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_2k65 1
1 2k65.mr . . XPLOR/CNS 11 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2k65 1
1 2k65.mr . . n/a 12 comment "Not applicable" "Not applicable" 0 parsed_2k65 1
1 2k65.mr . . XPLOR/CNS 13 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2k65 1
1 2k65.mr . . "MR format" 14 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k65 1
stop_
save_
save_CNS/XPLOR_dihedral_9
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2k65
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 9
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 13 . O5' . 13 . C5' . 13 . C4' . 13 . C3' parsed_2k65 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 13 . C4' . 13 . C3' . 13 . O3' . 14 . P parsed_2k65 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 13 . C3' . 13 . O3' . 14 . P . 14 . O5' parsed_2k65 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 13 . O3' . 14 . P . 14 . O5' . 14 . C5' parsed_2k65 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 14 . P . 14 . O5' . 14 . C5' . 14 . C4' parsed_2k65 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 14 . O5' . 14 . C5' . 14 . C4' . 14 . C3' parsed_2k65 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 14 . C4' . 14 . C3' . 14 . O3' . 15 . P parsed_2k65 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 14 . C3' . 14 . O3' . 15 . P . 15 . O5' parsed_2k65 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 14 . O3' . 15 . P . 15 . O5' . 15 . C5' parsed_2k65 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 15 . P . 15 . O5' . 15 . C5' . 15 . C4' parsed_2k65 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 15 . O5' . 15 . C5' . 15 . C4' . 15 . C3' parsed_2k65 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 15 . C4' . 15 . C3' . 15 . O3' . 16 . P parsed_2k65 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 15 . C3' . 15 . O3' . 16 . P . 16 . O5' parsed_2k65 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 15 . O3' . 16 . P . 16 . O5' . 16 . C5' parsed_2k65 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 16 . P . 16 . O5' . 16 . C5' . 16 . C4' parsed_2k65 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 16 . O5' . 16 . C5' . 16 . C4' . 16 . C3' parsed_2k65 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 16 . C4' . 16 . C3' . 16 . O3' . 17 . P parsed_2k65 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 16 . C3' . 16 . O3' . 17 . P . 17 . O5' parsed_2k65 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 16 . O3' . 17 . P . 17 . O5' . 17 . C5' parsed_2k65 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 17 . P . 17 . O5' . 17 . C5' . 17 . C4' parsed_2k65 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 17 . O5' . 17 . C5' . 17 . C4' . 17 . C3' parsed_2k65 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 17 . C4' . 17 . C3' . 17 . O3' . 18 . P parsed_2k65 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 17 . C3' . 17 . O3' . 18 . P . 18 . O5' parsed_2k65 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 17 . O3' . 18 . P . 18 . O5' . 18 . C5' parsed_2k65 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 18 . P . 18 . O5' . 18 . C5' . 18 . C4' parsed_2k65 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 18 . O5' . 18 . C5' . 18 . C4' . 18 . C3' parsed_2k65 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 18 . C4' . 18 . C3' . 18 . O3' . 19 . P parsed_2k65 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 18 . C3' . 18 . O3' . 19 . P . 19 . O5' parsed_2k65 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 18 . O3' . 19 . P . 19 . O5' . 19 . C5' parsed_2k65 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 19 . P . 19 . O5' . 19 . C5' . 19 . C4' parsed_2k65 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 19 . O5' . 19 . C5' . 19 . C4' . 19 . C3' parsed_2k65 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 59 . O5' . 59 . C5' . 59 . C4' . 59 . C3' parsed_2k65 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 59 . C4' . 59 . C3' . 59 . O3' . 60 . P parsed_2k65 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 59 . C3' . 59 . O3' . 60 . P . 60 . O5' parsed_2k65 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 59 . O3' . 60 . P . 60 . O5' . 60 . C5' parsed_2k65 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 60 . P . 60 . O5' . 60 . C5' . 60 . C4' parsed_2k65 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 60 . O5' . 60 . C5' . 60 . C4' . 60 . C3' parsed_2k65 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 60 . C4' . 60 . C3' . 60 . O3' . 61 . P parsed_2k65 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 60 . C3' . 60 . O3' . 61 . P . 61 . O5' parsed_2k65 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 60 . O3' . 61 . P . 61 . O5' . 61 . C5' parsed_2k65 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 61 . P . 61 . O5' . 61 . C5' . 61 . C4' parsed_2k65 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 61 . O5' . 61 . C5' . 61 . C4' . 61 . C3' parsed_2k65 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 61 . C4' . 61 . C3' . 61 . O3' . 62 . P parsed_2k65 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 61 . C3' . 61 . O3' . 62 . P . 62 . O5' parsed_2k65 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 61 . O3' . 62 . P . 62 . O5' . 62 . C5' parsed_2k65 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 62 . P . 62 . O5' . 62 . C5' . 62 . C4' parsed_2k65 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 62 . O5' . 62 . C5' . 62 . C4' . 62 . C3' parsed_2k65 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 62 . C4' . 62 . C3' . 62 . O3' . 63 . P parsed_2k65 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 62 . C3' . 62 . O3' . 63 . P . 63 . O5' parsed_2k65 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 62 . O3' . 63 . P . 63 . O5' . 63 . C5' parsed_2k65 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 63 . P . 63 . O5' . 63 . C5' . 63 . C4' parsed_2k65 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 63 . O5' . 63 . C5' . 63 . C4' . 63 . C3' parsed_2k65 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 63 . C4' . 63 . C3' . 63 . O3' . 64 . P parsed_2k65 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 63 . C3' . 63 . O3' . 64 . P . 64 . O5' parsed_2k65 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 63 . O3' . 64 . P . 64 . O5' . 64 . C5' parsed_2k65 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 64 . P . 64 . O5' . 64 . C5' . 64 . C4' parsed_2k65 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 64 . O5' . 64 . C5' . 64 . C4' . 64 . C3' parsed_2k65 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -141.7 . . 64 . C4' . 64 . C3' . 64 . O3' . 65 . P parsed_2k65 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.6 -63.6 . . 64 . C3' . 64 . O3' . 65 . P . 65 . O5' parsed_2k65 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -52.1 . . 64 . O3' . 65 . P . 65 . O5' . 65 . C5' parsed_2k65 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -169.9 . . 65 . P . 65 . O5' . 65 . C5' . 65 . C4' parsed_2k65 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 37.44 57.44 . . 65 . O5' . 65 . C5' . 65 . C4' . 65 . C3' parsed_2k65 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 *gamma* 4 62 4 62 parsed_2k65 1
2 *epsilon* 9 62 9 62 parsed_2k65 1
3 *zeta* 14 62 14 62 parsed_2k65 1
4 *alpha* 20 62 20 62 parsed_2k65 1
5 *beta* 25 62 25 62 parsed_2k65 1
6 *gamma* 30 62 30 62 parsed_2k65 1
7 *epsilon* 35 62 35 62 parsed_2k65 1
8 *zeta* 40 62 40 62 parsed_2k65 1
9 *alpha* 45 62 45 62 parsed_2k65 1
10 *beta* 50 62 50 62 parsed_2k65 1
11 *gamma* 55 62 55 62 parsed_2k65 1
12 *epsilon* 60 62 60 62 parsed_2k65 1
13 *zeta* 65 62 65 62 parsed_2k65 1
14 *alpha* 70 62 70 62 parsed_2k65 1
15 *beta* 75 62 75 62 parsed_2k65 1
16 *gamma* 80 62 80 62 parsed_2k65 1
17 *epsilon* 85 62 85 62 parsed_2k65 1
18 *zeta* 90 62 90 62 parsed_2k65 1
19 *alpha* 95 62 95 62 parsed_2k65 1
20 *beta* 100 62 100 62 parsed_2k65 1
21 *gamma* 105 62 105 62 parsed_2k65 1
22 *epsilon* 110 62 110 62 parsed_2k65 1
23 *zeta* 115 62 115 62 parsed_2k65 1
24 *alpha* 120 62 120 62 parsed_2k65 1
25 *beta* 125 62 125 62 parsed_2k65 1
26 *gamma* 130 62 130 62 parsed_2k65 1
27 *epsilon* 135 62 135 62 parsed_2k65 1
28 *zeta* 140 62 140 62 parsed_2k65 1
29 *alpha* 145 62 145 62 parsed_2k65 1
30 *beta* 150 62 150 62 parsed_2k65 1
31 *gamma* 155 62 155 62 parsed_2k65 1
32 *gamma* 160 62 160 62 parsed_2k65 1
33 *epsilon* 165 62 165 62 parsed_2k65 1
34 *zeta* 170 62 170 62 parsed_2k65 1
35 *alpha* 175 62 175 62 parsed_2k65 1
36 *beta* 180 62 180 62 parsed_2k65 1
37 *gamma* 185 62 185 62 parsed_2k65 1
38 *epsilon* 190 62 190 62 parsed_2k65 1
39 *zeta* 195 62 195 62 parsed_2k65 1
40 *alpha* 200 62 200 62 parsed_2k65 1
41 *beta* 205 62 205 62 parsed_2k65 1
42 *gamma* 210 62 210 62 parsed_2k65 1
43 *epsilon* 215 62 215 62 parsed_2k65 1
44 *zeta* 220 62 220 62 parsed_2k65 1
45 *alpha* 225 62 225 62 parsed_2k65 1
46 *beta* 230 62 230 62 parsed_2k65 1
47 *gamma* 235 62 235 62 parsed_2k65 1
48 *epsilon* 240 62 240 62 parsed_2k65 1
49 *zeta* 245 62 245 62 parsed_2k65 1
50 *alpha* 250 62 250 62 parsed_2k65 1
51 *beta* 255 62 255 62 parsed_2k65 1
52 *gamma* 260 62 260 62 parsed_2k65 1
53 *epsilon* 265 62 265 62 parsed_2k65 1
54 *zeta* 270 62 270 62 parsed_2k65 1
55 *alpha* 275 62 275 62 parsed_2k65 1
56 *beta* 280 62 280 62 parsed_2k65 1
57 *gamma* 285 62 285 62 parsed_2k65 1
58 *epsilon* 290 62 290 62 parsed_2k65 1
59 *zeta* 295 62 295 62 parsed_2k65 1
60 *alpha* 300 62 300 62 parsed_2k65 1
61 *beta* 305 62 305 62 parsed_2k65 1
62 *gamma* 310 62 310 62 parsed_2k65 1
stop_
save_
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