Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
29248 | 1ao9 RC | cing | 2-parsed | STAR | dihedral angle | 36 |
data_1ao9_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1ao9
_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_1ao9 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1ao9
_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 1ao9 "Master copy" parsed_1ao9
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1ao9
_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 1ao9.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1ao9 1
1 1ao9.mr . . DISCOVER 2 distance "hydrogen bond" simple 27 parsed_1ao9 1
1 1ao9.mr . . DISCOVER 3 distance NOE simple 111 parsed_1ao9 1
1 1ao9.mr . . DISCOVER 4 "dihedral angle" "Not applicable" "Not applicable" 36 parsed_1ao9 1
1 1ao9.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1ao9 1
stop_
save_
save_Discover_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1ao9
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130 155 . 1 1 G5' C5' 1 1 G5' C4' 1 1 G5' C3' 1 1 G5' O3' parsed_1ao9 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130 152 . 1 2 A C5' 1 2 A C4' 1 2 A C3' 1 2 A O3' parsed_1ao9 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130 155 . 1 3 G C5' 1 3 G C4' 1 3 G C3' 1 3 G O3' parsed_1ao9 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130 155 . 1 4 A C5' 1 4 A C4' 1 4 A C3' 1 4 A O3' parsed_1ao9 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 132 155 . 1 5 G C5' 1 5 G C4' 1 5 G C3' 1 5 G O3' parsed_1ao9 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 129 160 . 1 6 A3' C5' 1 6 A3' C4' 1 6 A3' C3' 1 6 A3' O3' parsed_1ao9 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130 158 . B 1 T5' C5' B 1 T5' C4' B 1 T5' C3' B 1 T5' O3' parsed_1ao9 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130 155 . B 2 C C5' B 2 C C4' B 2 C C3' B 2 C O3' parsed_1ao9 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120 152 . B 3 T C5' B 3 T C4' B 3 T C3' B 3 T O3' parsed_1ao9 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105 142 . B 4 C C5' B 4 C C4' B 4 C C3' B 4 C O3' parsed_1ao9 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130 156 . B 5 T C5' B 5 T C4' B 5 T C3' B 5 T O3' parsed_1ao9 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110 160 . B 6 C3' C5' B 6 C3' C4' B 6 C3' C3' B 6 C3' O3' parsed_1ao9 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130 -115 . 1 1 G5' O4' 1 1 G5' C1' 1 1 G5' N9 1 1 G5' C4 parsed_1ao9 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125 -110 . 1 2 A O4' 1 2 A C1' 1 2 A N9 1 2 A C4 parsed_1ao9 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -110 . 1 3 G O4' 1 3 G C1' 1 3 G N9 1 3 G C4 parsed_1ao9 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125 -115 . 1 4 A O4' 1 4 A C1' 1 4 A N9 1 4 A C4 parsed_1ao9 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130 -115 . 1 5 G O4' 1 5 G C1' 1 5 G N9 1 5 G C4 parsed_1ao9 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130 -115 . 1 6 A3' O4' 1 6 A3' C1' 1 6 A3' N9 1 6 A3' C4 parsed_1ao9 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131 -115 . B 1 T5' O4' B 1 T5' C1' B 1 T5' N1 B 1 T5' C2 parsed_1ao9 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133 -119 . B 2 C O4' B 2 C C1' B 2 C N1 B 2 C C2 parsed_1ao9 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130 -115 . B 3 T O4' B 3 T C1' B 3 T N1 B 3 T C2 parsed_1ao9 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130 -115 . B 4 C O4' B 4 C C1' B 4 C N1 B 4 C C2 parsed_1ao9 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -126 -110 . B 5 T O4' B 5 T C1' B 5 T N1 B 5 T C2 parsed_1ao9 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137 -110 . B 6 C3' O4' B 6 C3' C1' B 6 C3' N1 B 6 C3' C2 parsed_1ao9 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . 1 1 G5' O5' 1 1 G5' C5' 1 1 G5' C4' 1 1 G5' C3' parsed_1ao9 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . 1 2 A O5' 1 2 A C5' 1 2 A C4' 1 2 A C3' parsed_1ao9 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . 1 3 G O5' 1 3 G C5' 1 3 G C4' 1 3 G C3' parsed_1ao9 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . 1 4 A O5' 1 4 A C5' 1 4 A C4' 1 4 A C3' parsed_1ao9 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . 1 5 G O5' 1 5 G C5' 1 5 G C4' 1 5 G C3' parsed_1ao9 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . 1 6 A3' O5' 1 6 A3' C5' 1 6 A3' C4' 1 6 A3' C3' parsed_1ao9 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . B 1 T5' O5' B 1 T5' C5' B 1 T5' C4' B 1 T5' C3' parsed_1ao9 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . B 2 C O5' B 2 C C5' B 2 C C4' B 2 C C3' parsed_1ao9 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . B 3 T O5' B 3 T C5' B 3 T C4' B 3 T C3' parsed_1ao9 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . B 4 C O5' B 4 C C5' B 4 C C4' B 4 C C3' parsed_1ao9 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . B 5 T O5' B 5 T C5' B 5 T C4' B 5 T C3' parsed_1ao9 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20 100 . B 6 C3' O5' B 6 C3' C5' B 6 C3' C4' B 6 C3' C3' parsed_1ao9 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
;
NMR_dihedral
DELTA
;
1 1 3 64 parsed_1ao9 1
2 CHI 17 1 18 64 parsed_1ao9 1
3 GAMMA 32 1 33 8 parsed_1ao9 1
stop_
save_