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 |
|
|
30473 |
1cn2   |
4218 | cing | 2-parsed | STAR | dihedral angle | 58 |
data_1cn2_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1cn2
_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_1cn2 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1cn2
_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 1cn2 "Master copy" parsed_1cn2
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1cn2
_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 1cn2.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1cn2 1
1 1cn2.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1cn2 1
1 1cn2.mr . . DYANA/DIANA 3 distance NOE simple 876 parsed_1cn2 1
1 1cn2.mr . . DYANA/DIANA 4 distance "disulfide bond" simple 12 parsed_1cn2 1
1 1cn2.mr . . DYANA/DIANA 5 "dihedral angle" "Not applicable" "Not applicable" 58 parsed_1cn2 1
1 1cn2.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1cn2 1
stop_
save_
save_DYANA/DIANA_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1cn2
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 5
_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 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 2 GLU- . . . . . . . . . . . . . parsed_1cn2 1
2 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 6 VAL . . . . . . . . . . . . . parsed_1cn2 1
3 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 6 VAL . . . . . . . . . . . . . parsed_1cn2 1
4 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 8 LYS+ . . . . . . . . . . . . . parsed_1cn2 1
5 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 8 LYS+ . . . . . . . . . . . . . parsed_1cn2 1
6 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 10 THR . . . . . . . . . . . . . parsed_1cn2 1
7 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 10 THR . . . . . . . . . . . . . parsed_1cn2 1
8 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 12 CYSS . . . . . . . . . . . . . parsed_1cn2 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 19 LEU . . . . . . . . . . . . . parsed_1cn2 1
10 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 21 ASP- . . . . . . . . . . . . . parsed_1cn2 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 22 ASN . . . . . . . . . . . . . parsed_1cn2 1
12 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 22 ASN . . . . . . . . . . . . . parsed_1cn2 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 23 ASP- . . . . . . . . . . . . . parsed_1cn2 1
14 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 24 TYR . . . . . . . . . . . . . parsed_1cn2 1
15 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 24 TYR . . . . . . . . . . . . . parsed_1cn2 1
16 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 25 CYSS . . . . . . . . . . . . . parsed_1cn2 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 26 LEU . . . . . . . . . . . . . parsed_1cn2 1
18 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 27 ARG+ . . . . . . . . . . . . . parsed_1cn2 1
19 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 27 ARG+ . . . . . . . . . . . . . parsed_1cn2 1
20 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 28 GLU- . . . . . . . . . . . . . parsed_1cn2 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 29 CYSS . . . . . . . . . . . . . parsed_1cn2 1
22 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 30 LYS+ . . . . . . . . . . . . . parsed_1cn2 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 31 GLN . . . . . . . . . . . . . parsed_1cn2 1
24 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 31 GLN . . . . . . . . . . . . . parsed_1cn2 1
25 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 32 GLN . . . . . . . . . . . . . parsed_1cn2 1
26 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 33 TYR . . . . . . . . . . . . . parsed_1cn2 1
27 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 33 TYR . . . . . . . . . . . . . parsed_1cn2 1
28 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 35 LYS+ . . . . . . . . . . . . . parsed_1cn2 1
29 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 35 LYS+ . . . . . . . . . . . . . parsed_1cn2 1
30 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 37 ALA . . . . . . . . . . . . . parsed_1cn2 1
31 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 40 TYR . . . . . . . . . . . . . parsed_1cn2 1
32 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -65.0 . . 41 CYSS . . . . . . . . . . . . . parsed_1cn2 1
33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 42 TYR . . . . . . . . . . . . . parsed_1cn2 1
34 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 42 TYR . . . . . . . . . . . . . parsed_1cn2 1
35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 43 ALA . . . . . . . . . . . . . parsed_1cn2 1
36 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -65.0 . . 45 ALA . . . . . . . . . . . . . parsed_1cn2 1
37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 47 TRP . . . . . . . . . . . . . parsed_1cn2 1
38 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 48 CYSS . . . . . . . . . . . . . parsed_1cn2 1
39 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 48 CYSS . . . . . . . . . . . . . parsed_1cn2 1
40 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 49 THR . . . . . . . . . . . . . parsed_1cn2 1
41 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -65.0 . . 50 HIS . . . . . . . . . . . . . parsed_1cn2 1
42 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 51 LEU . . . . . . . . . . . . . parsed_1cn2 1
43 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 52 TYR . . . . . . . . . . . . . parsed_1cn2 1
44 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 52 TYR . . . . . . . . . . . . . parsed_1cn2 1
45 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 54 GLN . . . . . . . . . . . . . parsed_1cn2 1
46 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 55 ALA . . . . . . . . . . . . . parsed_1cn2 1
47 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 56 ILE . . . . . . . . . . . . . parsed_1cn2 1
48 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 57 VAL . . . . . . . . . . . . . parsed_1cn2 1
49 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 57 VAL . . . . . . . . . . . . . parsed_1cn2 1
50 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -65.0 . . 62 ASN . . . . . . . . . . . . . parsed_1cn2 1
51 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 62 ASN . . . . . . . . . . . . . parsed_1cn2 1
52 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -65.0 . . 63 LYS+ . . . . . . . . . . . . . parsed_1cn2 1
53 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 63 LYS+ . . . . . . . . . . . . . parsed_1cn2 1
54 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -65.0 . . 64 ARG+ . . . . . . . . . . . . . parsed_1cn2 1
55 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 64 ARG+ . . . . . . . . . . . . . parsed_1cn2 1
56 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 65 CYSS . . . . . . . . . . . . . parsed_1cn2 1
57 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 66 SER . . . . . . . . . . . . . parsed_1cn2 1
58 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 100.0 . . 66 SER . . . . . . . . . . . . . parsed_1cn2 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 constraints#" 1 1 1 29 parsed_1cn2 1
stop_
save_
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