NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
48344 |
2ike   |
15106 | cing | 2-parsed | STAR | dihedral angle | 54 |
data_2ike_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2ike
_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_2ike 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2ike
_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 2ike "Master copy" parsed_2ike
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2ike
_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 2ike.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2ike 1
1 2ike.mr . . XPLOR/CNS 2 distance NOE simple 690 parsed_2ike 1
1 2ike.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 36 parsed_2ike 1
1 2ike.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 54 parsed_2ike 1
1 2ike.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2ike 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2ike
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.0 -89.0 . . 70 . c . 71 . n . 71 . ca . 71 . c parsed_2ike 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.0 153.0 . . 71 . n . 71 . ca . 71 . c . 72 . n parsed_2ike 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.0 -81.0 . . 71 . c . 72 . n . 72 . ca . 72 . c parsed_2ike 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.0 160.0 . . 72 . n . 72 . ca . 72 . c . 73 . n parsed_2ike 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.0 -125.0 . . 72 . c . 73 . n . 73 . ca . 73 . c parsed_2ike 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 139.0 167.0 . . 73 . n . 73 . ca . 73 . c . 74 . n parsed_2ike 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.0 -94.0 . . 73 . c . 74 . n . 74 . ca . 74 . c parsed_2ike 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.0 145.0 . . 74 . n . 74 . ca . 74 . c . 75 . n parsed_2ike 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.0 -98.0 . . 81 . c . 82 . n . 82 . ca . 82 . c parsed_2ike 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.0 152.0 . . 82 . n . 82 . ca . 82 . c . 83 . n parsed_2ike 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.0 -110.0 . . 82 . c . 83 . n . 83 . ca . 83 . c parsed_2ike 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.0 162.0 . . 83 . n . 83 . ca . 83 . c . 84 . n parsed_2ike 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.0 -116.0 . . 83 . c . 84 . n . 84 . ca . 84 . c parsed_2ike 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 129.0 157.0 . . 84 . n . 84 . ca . 84 . c . 85 . n parsed_2ike 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.0 -57.0 . . 89 . c . 90 . n . 90 . ca . 90 . c parsed_2ike 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42.0 -30.0 . . 90 . n . 90 . ca . 90 . c . 91 . n parsed_2ike 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -56.0 . . 90 . c . 91 . n . 91 . ca . 91 . c parsed_2ike 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.0 -31.0 . . 91 . n . 91 . ca . 91 . c . 92 . n parsed_2ike 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.0 -59.0 . . 91 . c . 92 . n . 92 . ca . 92 . c parsed_2ike 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.0 -38.0 . . 92 . n . 92 . ca . 92 . c . 93 . n parsed_2ike 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.0 -57.0 . . 92 . c . 93 . n . 93 . ca . 93 . c parsed_2ike 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.0 -26.0 . . 93 . n . 93 . ca . 93 . c . 94 . n parsed_2ike 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.0 -59.0 . . 93 . c . 94 . n . 94 . ca . 94 . c parsed_2ike 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.0 -35.0 . . 94 . n . 94 . ca . 94 . c . 95 . n parsed_2ike 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.0 -61.0 . . 94 . c . 95 . n . 95 . ca . 95 . c parsed_2ike 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.0 -35.0 . . 95 . n . 95 . ca . 95 . c . 96 . n parsed_2ike 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -58.0 . . 95 . c . 96 . n . 96 . ca . 96 . c parsed_2ike 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.0 -31.0 . . 96 . n . 96 . ca . 96 . c . 97 . n parsed_2ike 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.0 -64.0 . . 96 . c . 97 . n . 97 . ca . 97 . c parsed_2ike 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.0 -10.0 . . 97 . n . 97 . ca . 97 . c . 98 . n parsed_2ike 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.0 -53.0 . . 101 . c . 102 . n . 102 . ca . 102 . c parsed_2ike 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.0 -24.0 . . 102 . n . 102 . ca . 102 . c . 103 . n parsed_2ike 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.0 -56.0 . . 102 . c . 103 . n . 103 . ca . 103 . c parsed_2ike 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.0 -28.0 . . 103 . n . 103 . ca . 103 . c . 104 . n parsed_2ike 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 -61.0 . . 103 . c . 104 . n . 104 . ca . 104 . c parsed_2ike 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.0 -32.0 . . 104 . n . 104 . ca . 104 . c . 105 . n parsed_2ike 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.0 -60.0 . . 104 . c . 105 . n . 105 . ca . 105 . c parsed_2ike 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42.0 -30.0 . . 105 . n . 105 . ca . 105 . c . 106 . n parsed_2ike 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.0 -58.0 . . 105 . c . 106 . n . 106 . ca . 106 . c parsed_2ike 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.0 -34.0 . . 106 . n . 106 . ca . 106 . c . 107 . n parsed_2ike 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.0 -59.0 . . 106 . c . 107 . n . 107 . ca . 107 . c parsed_2ike 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.0 -34.0 . . 107 . n . 107 . ca . 107 . c . 108 . n parsed_2ike 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.0 -62.0 . . 107 . c . 108 . n . 108 . ca . 108 . c parsed_2ike 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.0 -35.0 . . 108 . n . 108 . ca . 108 . c . 109 . n parsed_2ike 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.0 -59.0 . . 108 . c . 109 . n . 109 . ca . 109 . c parsed_2ike 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.0 -22.0 . . 109 . n . 109 . ca . 109 . c . 110 . n parsed_2ike 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.0 -64.0 . . 109 . c . 110 . n . 110 . ca . 110 . c parsed_2ike 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.0 4.0 . . 110 . n . 110 . ca . 110 . c . 111 . n parsed_2ike 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.0 -118.0 . . 120 . c . 121 . n . 121 . ca . 121 . c parsed_2ike 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 139.0 163.0 . . 121 . n . 121 . ca . 121 . c . 122 . n parsed_2ike 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.0 -112.0 . . 121 . c . 122 . n . 122 . ca . 122 . c parsed_2ike 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.0 148.0 . . 122 . n . 122 . ca . 122 . c . 123 . n parsed_2ike 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.0 -102.0 . . 122 . c . 123 . n . 123 . ca . 123 . c parsed_2ike 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.0 137.0 . . 123 . n . 123 . ca . 123 . c . 124 . n parsed_2ike 1
stop_
save_
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