NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
31256 |
1e0z   |
cing | 2-parsed | STAR | dihedral angle | 56 |
data_1e0z_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1e0z
_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_1e0z 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1e0z
_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 1e0z "Master copy" parsed_1e0z
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1e0z
_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 1e0z.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1e0z 1
1 1e0z.mr . . "MR format" 2 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1e0z 1
1 1e0z.mr . . XPLOR/CNS 3 distance NOE simple 1258 parsed_1e0z 1
1 1e0z.mr . . XPLOR/CNS 4 distance "general distance" simple 780 parsed_1e0z 1
1 1e0z.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 92 parsed_1e0z 1
1 1e0z.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 56 parsed_1e0z 1
1 1e0z.mr . . XPLOR/CNS 7 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1e0z 1
1 1e0z.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1e0z 1
stop_
save_
save_CNS/XPLOR_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1e0z
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 6
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 8 . c . 9 . n . 9 . ca . 9 . c parsed_1e0z 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 10 . c . 11 . n . 11 . ca . 11 . c parsed_1e0z 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 11 . c . 12 . n . 12 . ca . 12 . c parsed_1e0z 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 17 . c . 18 . n . 18 . ca . 18 . c parsed_1e0z 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 19 . c . 20 . n . 20 . ca . 20 . c parsed_1e0z 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 20 . c . 21 . n . 21 . ca . 21 . c parsed_1e0z 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 23 . c . 24 . n . 24 . ca . 24 . c parsed_1e0z 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 25 . c . 26 . n . 26 . ca . 26 . c parsed_1e0z 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 26 . c . 27 . n . 27 . ca . 27 . c parsed_1e0z 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 32 . c . 33 . n . 33 . ca . 33 . c parsed_1e0z 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 34 . c . 35 . n . 35 . ca . 35 . c parsed_1e0z 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 42 . c . 43 . n . 43 . ca . 43 . c parsed_1e0z 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 43 . c . 44 . n . 44 . ca . 44 . c parsed_1e0z 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 46 . c . 47 . n . 47 . ca . 47 . c parsed_1e0z 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 49 . c . 50 . n . 50 . ca . 50 . c parsed_1e0z 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 50 . c . 51 . n . 51 . ca . 51 . c parsed_1e0z 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 51 . c . 52 . n . 52 . ca . 52 . c parsed_1e0z 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 52 . c . 53 . n . 53 . ca . 53 . c parsed_1e0z 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 53 . c . 54 . n . 54 . ca . 54 . c parsed_1e0z 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 83 . c . 84 . n . 84 . ca . 84 . c parsed_1e0z 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -190 -150 . . 84 . c . 85 . n . 85 . ca . 85 . c parsed_1e0z 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 89 . c . 90 . n . 90 . ca . 90 . c parsed_1e0z 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 90 . c . 91 . n . 91 . ca . 91 . c parsed_1e0z 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 91 . c . 92 . n . 92 . ca . 92 . c parsed_1e0z 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 92 . c . 93 . n . 93 . ca . 93 . c parsed_1e0z 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 121 . c . 122 . n . 122 . ca . 122 . c parsed_1e0z 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 124 . c . 125 . n . 125 . ca . 125 . c parsed_1e0z 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 126 . c . 127 . n . 127 . ca . 127 . c parsed_1e0z 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180 0 . . 31 . c . 32 . n . 32 . ca . 32 . c parsed_1e0z 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 1 . c . 2 . n . 2 . ca . 2 . c parsed_1e0z 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 2 . c . 3 . n . 3 . ca . 3 . c parsed_1e0z 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 3 . c . 4 . n . 4 . ca . 4 . c parsed_1e0z 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 4 . c . 5 . n . 5 . ca . 5 . c parsed_1e0z 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 5 . c . 6 . n . 6 . ca . 6 . c parsed_1e0z 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 15 . c . 16 . n . 16 . ca . 16 . c parsed_1e0z 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 18 . c . 19 . n . 19 . ca . 19 . c parsed_1e0z 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 35 . c . 36 . n . 36 . ca . 36 . c parsed_1e0z 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 38 . c . 39 . n . 39 . ca . 39 . c parsed_1e0z 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 39 . c . 40 . n . 40 . ca . 40 . c parsed_1e0z 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 45 . c . 46 . n . 46 . ca . 46 . c parsed_1e0z 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 54 . c . 55 . n . 55 . ca . 55 . c parsed_1e0z 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 57 . c . 58 . n . 58 . ca . 58 . c parsed_1e0z 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 73 . c . 74 . n . 74 . ca . 74 . c parsed_1e0z 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 75 . c . 76 . n . 76 . ca . 76 . c parsed_1e0z 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 80 . c . 81 . n . 81 . ca . 81 . c parsed_1e0z 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 94 . c . 95 . n . 95 . ca . 95 . c parsed_1e0z 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 95 . c . 96 . n . 96 . ca . 96 . c parsed_1e0z 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 104 . c . 105 . n . 105 . ca . 105 . c parsed_1e0z 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 106 . c . 107 . n . 107 . ca . 107 . c parsed_1e0z 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 109 . c . 110 . n . 110 . ca . 110 . c parsed_1e0z 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 110 . c . 111 . n . 111 . ca . 111 . c parsed_1e0z 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 111 . c . 112 . n . 112 . ca . 112 . c parsed_1e0z 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 112 . c . 113 . n . 113 . ca . 113 . c parsed_1e0z 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 113 . c . 114 . n . 114 . ca . 114 . c parsed_1e0z 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 114 . c . 115 . n . 115 . ca . 115 . c parsed_1e0z 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160 -80 . . 122 . c . 123 . n . 123 . ca . 123 . c parsed_1e0z 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 "Phi-angle restraints deduced from HNHA-experiments" 2 1 2 53 parsed_1e0z 1
stop_
save_
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