Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | item_count |
|
|
34145 | 1jfn RC | 5075 | cing | recoord | 2-parsed | STAR | dihedral angle | 84 |
data_1jfn_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1jfn
_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_1jfn 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1jfn
_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 1jfn "Master copy" parsed_1jfn
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1jfn
_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 1jfn.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1jfn 1
1 1jfn.mr . . XPLOR/CNS 2 distance NOE simple 937 parsed_1jfn 1
1 1jfn.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 84 parsed_1jfn 1
1 1jfn.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1jfn 1
1 1jfn.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1jfn 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1jfn
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 9 . c . 10 . n . 10 . ca . 10 . c parsed_1jfn 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 10 . c . 11 . n . 11 . ca . 11 . c parsed_1jfn 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 12 . c . 13 . n . 13 . ca . 13 . c parsed_1jfn 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 13 . c . 14 . n . 14 . ca . 14 . c parsed_1jfn 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 15 . c . 16 . n . 16 . ca . 16 . c parsed_1jfn 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -101.0 -61.0 . . 16 . c . 17 . n . 17 . ca . 17 . c parsed_1jfn 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 17 . c . 18 . n . 18 . ca . 18 . c parsed_1jfn 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 18 . c . 19 . n . 19 . ca . 19 . c parsed_1jfn 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 21 . c . 22 . n . 22 . ca . 22 . c parsed_1jfn 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 23 . c . 24 . n . 24 . ca . 24 . c parsed_1jfn 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 24 . c . 25 . n . 25 . ca . 25 . c parsed_1jfn 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.0 -86.0 . . 25 . c . 26 . n . 26 . ca . 26 . c parsed_1jfn 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.0 -100.0 . . 26 . c . 27 . n . 27 . ca . 27 . c parsed_1jfn 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 28 . c . 29 . n . 29 . ca . 29 . c parsed_1jfn 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 30 . c . 31 . n . 31 . ca . 31 . c parsed_1jfn 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 35 . c . 36 . n . 36 . ca . 36 . c parsed_1jfn 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 36 . c . 37 . n . 37 . ca . 37 . c parsed_1jfn 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.0 -64.0 . . 37 . c . 38 . n . 38 . ca . 38 . c parsed_1jfn 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.0 -101.0 . . 38 . c . 39 . n . 39 . ca . 39 . c parsed_1jfn 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 39 . c . 40 . n . 40 . ca . 40 . c parsed_1jfn 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 40 . c . 41 . n . 41 . ca . 41 . c parsed_1jfn 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 41 . c . 42 . n . 42 . ca . 42 . c parsed_1jfn 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.0 -71.0 . . 43 . c . 44 . n . 44 . ca . 44 . c parsed_1jfn 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 44 . c . 45 . n . 45 . ca . 45 . c parsed_1jfn 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -58.0 . . 46 . c . 47 . n . 47 . ca . 47 . c parsed_1jfn 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 47 . c . 48 . n . 48 . ca . 48 . c parsed_1jfn 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.0 -49.0 . . 49 . c . 50 . n . 50 . ca . 50 . c parsed_1jfn 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 50 . c . 51 . n . 51 . ca . 51 . c parsed_1jfn 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 51 . c . 52 . n . 52 . ca . 52 . c parsed_1jfn 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 52 . c . 53 . n . 53 . ca . 53 . c parsed_1jfn 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 54 . c . 55 . n . 55 . ca . 55 . c parsed_1jfn 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -103.0 -51.0 . . 55 . c . 56 . n . 56 . ca . 56 . c parsed_1jfn 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 57 . c . 58 . n . 58 . ca . 58 . c parsed_1jfn 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.0 -57.0 . . 60 . c . 61 . n . 61 . ca . 61 . c parsed_1jfn 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.0 -57.0 . . 61 . c . 62 . n . 62 . ca . 62 . c parsed_1jfn 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 62 . c . 63 . n . 63 . ca . 63 . c parsed_1jfn 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 63 . c . 64 . n . 64 . ca . 64 . c parsed_1jfn 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 65 . c . 66 . n . 66 . ca . 66 . c parsed_1jfn 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 69 . c . 70 . n . 70 . ca . 70 . c parsed_1jfn 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 71 . c . 72 . n . 72 . ca . 72 . c parsed_1jfn 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 74 . c . 75 . n . 75 . ca . 75 . c parsed_1jfn 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 75 . c . 76 . n . 76 . ca . 76 . c parsed_1jfn 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 77 . c . 78 . n . 78 . ca . 78 . c parsed_1jfn 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.0 -56.0 . . 79 . c . 80 . n . 80 . ca . 80 . c parsed_1jfn 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 83 . c . 84 . n . 84 . ca . 84 . c parsed_1jfn 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 85 . c . 86 . n . 86 . ca . 86 . c parsed_1jfn 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 86 . c . 87 . n . 87 . ca . 87 . c parsed_1jfn 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 87 . c . 88 . n . 88 . ca . 88 . c parsed_1jfn 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 88 . c . 89 . n . 89 . ca . 89 . c parsed_1jfn 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 90 . c . 91 . n . 91 . ca . 91 . c parsed_1jfn 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.0 -77.0 . . 91 . c . 92 . n . 92 . ca . 92 . c parsed_1jfn 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 92 . c . 93 . n . 93 . ca . 93 . c parsed_1jfn 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 93 . c . 94 . n . 94 . ca . 94 . c parsed_1jfn 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 95 . c . 96 . n . 96 . ca . 96 . c parsed_1jfn 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 97 . c . 98 . n . 98 . ca . 98 . c parsed_1jfn 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -154.0 -104.0 . . 98 . c . 99 . n . 99 . ca . 99 . c parsed_1jfn 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 99 . c . 100 . n . 100 . ca . 100 . c parsed_1jfn 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 100 . c . 101 . n . 101 . ca . 101 . c parsed_1jfn 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 103 . c . 104 . n . 104 . ca . 104 . c parsed_1jfn 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 104 . c . 105 . n . 105 . ca . 105 . c parsed_1jfn 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 106 . c . 107 . n . 107 . ca . 107 . c parsed_1jfn 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 108 . c . 109 . n . 109 . ca . 109 . c parsed_1jfn 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 109 . c . 110 . n . 110 . ca . 110 . c parsed_1jfn 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 110 . c . 111 . n . 111 . ca . 111 . c parsed_1jfn 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 111 . c . 112 . n . 112 . ca . 112 . c parsed_1jfn 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 112 . c . 113 . n . 113 . ca . 113 . c parsed_1jfn 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 113 . c . 114 . n . 114 . ca . 114 . c parsed_1jfn 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 114 . c . 115 . n . 115 . ca . 115 . c parsed_1jfn 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 115 . c . 116 . n . 116 . ca . 116 . c parsed_1jfn 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.0 -86.0 . . 116 . c . 117 . n . 117 . ca . 117 . c parsed_1jfn 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -50.0 . . 118 . c . 119 . n . 119 . ca . 119 . c parsed_1jfn 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.0 155.0 . . 17 . n . 17 . ca . 17 . c . 18 . n parsed_1jfn 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.0 138.0 . . 22 . n . 22 . ca . 22 . c . 23 . n parsed_1jfn 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.0 154.0 . . 39 . n . 39 . ca . 39 . c . 40 . n parsed_1jfn 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 178.0 . . 40 . n . 40 . ca . 40 . c . 41 . n parsed_1jfn 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.0 158.0 . . 47 . n . 47 . ca . 47 . c . 48 . n parsed_1jfn 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.0 -16.0 . . 49 . n . 49 . ca . 49 . c . 50 . n parsed_1jfn 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.0 146.0 . . 56 . n . 56 . ca . 56 . c . 57 . n parsed_1jfn 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.0 -14.0 . . 61 . n . 61 . ca . 61 . c . 62 . n parsed_1jfn 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.0 -23.0 . . 62 . n . 62 . ca . 62 . c . 63 . n parsed_1jfn 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 160.0 . . 70 . n . 70 . ca . 70 . c . 71 . n parsed_1jfn 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 138.0 168.0 . . 99 . n . 99 . ca . 99 . c . 100 . n parsed_1jfn 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.0 158.0 . . 100 . n . 100 . ca . 100 . c . 101 . n parsed_1jfn 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 150.0 . . 117 . n . 117 . ca . 117 . c . 118 . n parsed_1jfn 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 dihedralrestraints 2 1 2 20 parsed_1jfn 1
2 "message=off echo=off" 4 1 4 28 parsed_1jfn 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" 5 1 5 25 parsed_1jfn 1
stop_
save_