Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
42134 | 1y1c RC | 6387 | cing | 2-parsed | STAR | dihedral angle | 57 |
data_1y1c_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1y1c
_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_1y1c 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1y1c
_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 1y1c "Master copy" parsed_1y1c
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1y1c
_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 1y1c.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1y1c 1
1 1y1c.mr . . XPLOR/CNS 2 distance NOE simple 664 parsed_1y1c 1
1 1y1c.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 46 parsed_1y1c 1
1 1y1c.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 57 parsed_1y1c 1
1 1y1c.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1y1c 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1y1c
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -20.0 . . 2 . c . 3 . n . 3 . ca . 3 . c parsed_1y1c 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -20.0 . . 3 . c . 4 . n . 4 . ca . 4 . c parsed_1y1c 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 5 . c . 6 . n . 6 . ca . 6 . c parsed_1y1c 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 6 . c . 7 . n . 7 . ca . 7 . c parsed_1y1c 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 7 . c . 8 . n . 8 . ca . 8 . c parsed_1y1c 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 8 . n . 8 . ca . 8 . cb . 8 . sg parsed_1y1c 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 8 . c . 9 . n . 9 . ca . 9 . c parsed_1y1c 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 9 . c . 10 . n . 10 . ca . 10 . c parsed_1y1c 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 10 . n . 10 . ca . 10 . cb . 10 . cg parsed_1y1c 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -20.0 . . 11 . c . 12 . n . 12 . ca . 12 . c parsed_1y1c 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 12 . c . 13 . n . 13 . ca . 13 . c parsed_1y1c 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.0 240.0 . . 13 . n . 13 . ca . 13 . cb . 13 . cg parsed_1y1c 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 15 . c . 16 . n . 16 . ca . 16 . c parsed_1y1c 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 16 . n . 16 . ca . 16 . c . 17 . n parsed_1y1c 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 16 . n . 16 . ca . 16 . cb . 16 . sg parsed_1y1c 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 20 . c . 21 . n . 21 . ca . 21 . c parsed_1y1c 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 21 . n . 21 . ca . 21 . c . 22 . n parsed_1y1c 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 21 . c . 22 . n . 22 . ca . 22 . c parsed_1y1c 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 22 . n . 22 . ca . 22 . c . 23 . n parsed_1y1c 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 22 . c . 23 . n . 23 . ca . 23 . c parsed_1y1c 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 23 . n . 23 . ca . 23 . c . 24 . n parsed_1y1c 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 23 . n . 23 . ca . 23 . cb . 23 . cg parsed_1y1c 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 25 . c . 26 . n . 26 . ca . 26 . c parsed_1y1c 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -10.0 . . 26 . n . 26 . ca . 26 . c . 27 . n parsed_1y1c 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 26 . c . 27 . n . 27 . ca . 27 . c parsed_1y1c 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -10.0 . . 27 . n . 27 . ca . 27 . c . 28 . n parsed_1y1c 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 27 . n . 27 . ca . 27 . cb . 27 . sg parsed_1y1c 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 27 . c . 28 . n . 28 . ca . 28 . c parsed_1y1c 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -10.0 . . 28 . n . 28 . ca . 28 . c . 29 . n parsed_1y1c 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 28 . n . 28 . ca . 28 . cb . 28 . cg parsed_1y1c 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 28 . c . 29 . n . 29 . ca . 29 . c parsed_1y1c 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -10.0 . . 29 . n . 29 . ca . 29 . c . 30 . n parsed_1y1c 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 29 . n . 29 . ca . 29 . cb . 29 . cg parsed_1y1c 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 29 . c . 30 . n . 30 . ca . 30 . c parsed_1y1c 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -10.0 . . 30 . n . 30 . ca . 30 . c . 31 . n parsed_1y1c 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 30 . n . 30 . ca . 30 . cb . 30 . cg parsed_1y1c 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 30 . c . 31 . n . 31 . ca . 31 . c parsed_1y1c 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -10.0 . . 31 . n . 31 . ca . 31 . c . 32 . n parsed_1y1c 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 31 . c . 32 . n . 32 . ca . 32 . c parsed_1y1c 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -10.0 . . 32 . n . 32 . ca . 32 . c . 33 . n parsed_1y1c 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 32 . c . 33 . n . 33 . ca . 33 . c parsed_1y1c 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 33 . c . 34 . n . 34 . ca . 34 . c parsed_1y1c 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 34 . c . 35 . n . 35 . ca . 35 . c parsed_1y1c 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 -70.0 . . 35 . c . 36 . n . 36 . ca . 36 . c parsed_1y1c 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.0 240.0 . . 36 . n . 36 . ca . 36 . cb . 36 . og parsed_1y1c 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -20.0 . . 36 . c . 37 . n . 37 . ca . 37 . c parsed_1y1c 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 37 . c . 38 . n . 38 . ca . 38 . c parsed_1y1c 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -20.0 . . 39 . c . 40 . n . 40 . ca . 40 . c parsed_1y1c 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 40 . c . 41 . n . 41 . ca . 41 . c parsed_1y1c 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 42 . n . 42 . ca . 42 . cb . 42 . cg parsed_1y1c 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 42 . c . 43 . n . 43 . ca . 43 . c parsed_1y1c 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -20.0 . . 44 . c . 45 . n . 45 . ca . 45 . c parsed_1y1c 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 46 . c . 47 . n . 47 . ca . 47 . c parsed_1y1c 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 48 . n . 48 . ca . 48 . cb . 48 . sg parsed_1y1c 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -20.0 . . 44 . c . 45 . n . 45 . ca . 45 . c parsed_1y1c 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 46 . c . 47 . n . 47 . ca . 47 . c parsed_1y1c 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 48 . n . 48 . ca . 48 . cb . 48 . sg parsed_1y1c 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
;
dihedral angles
D3
;
2 1 4 4 parsed_1y1c 1
2
;
Phi
A4
;
6 69 8 4 parsed_1y1c 1
3
;
Phi
C6
;
10 69 12 4 parsed_1y1c 1
4
;
Phi
I7
;
14 69 16 4 parsed_1y1c 1
5
;
Phi
C8
;
18 69 20 4 parsed_1y1c 1
6 Phi 22 69 22 73 parsed_1y1c 1
7
;
Chi 1
T9
;
24 74 27 4 parsed_1y1c 1
8
;
Phi
M10
;
29 69 31 5 parsed_1y1c 1
9 Phi 33 71 33 75 parsed_1y1c 1
10
;
Chi 1
Y12
;
35 76 38 5 parsed_1y1c 1
11
;
Phi
D13
;
40 71 42 5 parsed_1y1c 1
12 Phi 44 71 44 75 parsed_1y1c 1
13
;
Chi 1
C16
;
46 76 49 5 parsed_1y1c 1
14 Phi 51 71 51 75 parsed_1y1c 1
15 Psi 53 70 53 74 parsed_1y1c 1
16
;
Chi 1
I21
;
55 76 57 5 parsed_1y1c 1
17 Phi 59 71 59 76 parsed_1y1c 1
18
;
Psi
T22
;
61 70 63 5 parsed_1y1c 1
19 Phi 65 71 65 75 parsed_1y1c 1
20
;
Psi
Y23
;
67 70 69 5 parsed_1y1c 1
21 Phi 71 71 71 75 parsed_1y1c 1
22 Psi 73 70 73 74 parsed_1y1c 1
23
;
Chi 1
A26
;
75 76 77 5 parsed_1y1c 1
24 Phi 79 70 79 74 parsed_1y1c 1
25
;
Psi
C27
;
81 70 82 5 parsed_1y1c 1
26 Phi 84 70 84 74 parsed_1y1c 1
27 Psi 86 70 86 74 parsed_1y1c 1
28
;
Chi 1
M28
;
88 76 90 5 parsed_1y1c 1
29 Phi 92 70 92 74 parsed_1y1c 1
30 Psi 94 70 94 74 parsed_1y1c 1
31
;
Chi 1
L29
;
96 76 98 5 parsed_1y1c 1
32 Phi 100 70 100 74 parsed_1y1c 1
33 Psi 102 70 102 74 parsed_1y1c 1
34
;
Chi 1
L30
;
104 76 106 5 parsed_1y1c 1
35 Phi 108 70 108 74 parsed_1y1c 1
36 Psi 110 70 110 74 parsed_1y1c 1
37
;
Chi 1
C31
;
112 76 114 5 parsed_1y1c 1
38 Phi 116 70 116 74 parsed_1y1c 1
39
;
Psi
A32
;
118 70 120 5 parsed_1y1c 1
40 Phi 122 70 122 75 parsed_1y1c 1
41
;
Psi
S33
;
124 70 126 5 parsed_1y1c 1
42
;
Phi
A34
;
128 70 130 5 parsed_1y1c 1
43
;
Phi
R35
;
132 70 134 5 parsed_1y1c 1
44
;
Phi
S36
;
136 71 138 5 parsed_1y1c 1
45 Phi 140 71 140 75 parsed_1y1c 1
46
;
Chi 1
D37
;
142 76 144 5 parsed_1y1c 1
47
;
Phi
T38
;
146 71 148 5 parsed_1y1c 1
48
;
Phi
I40
;
150 71 152 5 parsed_1y1c 1
49
;
Phi
E41
;
154 71 156 5 parsed_1y1c 1
50
;
Phi
L42
;
158 71 160 5 parsed_1y1c 1
51
;
Chi 1
V43
;
162 76 164 5 parsed_1y1c 1
52
;
Phi
H44
K45
;
166 71 170 5 parsed_1y1c 1
53
;
Phi
R47
;
172 71 174 5 parsed_1y1c 1
54
;
Phi
C48
;
176 70 178 5 parsed_1y1c 1
55
;
Chi 1
K45
;
180 76 182 5 parsed_1y1c 1
56
;
Phi
R47
;
184 71 186 5 parsed_1y1c 1
57
;
Phi
C48
;
188 70 190 5 parsed_1y1c 1
58 "Chi 1" 192 76 192 82 parsed_1y1c 1
stop_
save_