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 |
|
|
607211 |
2n6n   |
25774 | cing | 2-parsed | STAR | dihedral angle | 56 |
data_2n6n_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2n6n
_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_2n6n 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2n6n
_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 2n6n "Master copy" parsed_2n6n
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2n6n
_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 2n6n.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2n6n 1
1 2n6n.mr . . XEASY 2 peak "Not applicable" "Not applicable" 0 parsed_2n6n 1
1 2n6n.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 56 parsed_2n6n 1
1 2n6n.mr . . DYANA/DIANA 4 distance "general distance" simple 0 parsed_2n6n 1
1 2n6n.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2n6n 1
stop_
save_
save_DYANA/DIANA_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2n6n
_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 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -171.0 -55.0 . . 2 TYR . . . . . . . . . . . . . parsed_2n6n 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 204.0 . . 2 TYR . . . . . . . . . . . . . parsed_2n6n 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -177.0 -89.0 . . 3 CYSS . . . . . . . . . . . . . parsed_2n6n 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.0 178.0 . . 3 CYSS . . . . . . . . . . . . . parsed_2n6n 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.0 -85.0 . . 4 ALA . . . . . . . . . . . . . parsed_2n6n 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.0 168.0 . . 4 ALA . . . . . . . . . . . . . parsed_2n6n 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.0 -67.0 . . 5 GLU . . . . . . . . . . . . . parsed_2n6n 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.0 214.0 . . 5 GLU . . . . . . . . . . . . . parsed_2n6n 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -39.0 . . 6 LYS . . . . . . . . . . . . . parsed_2n6n 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.0 161.0 . . 6 LYS . . . . . . . . . . . . . parsed_2n6n 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 112.0 . . 7 GLY . . . . . . . . . . . . . parsed_2n6n 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -24.0 12.0 . . 7 GLY . . . . . . . . . . . . . parsed_2n6n 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -104.0 -76.0 . . 8 ILE . . . . . . . . . . . . . parsed_2n6n 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 59.0 143.0 . . 8 ILE . . . . . . . . . . . . . parsed_2n6n 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -197.0 -53.0 . . 10 CYSS . . . . . . . . . . . . . parsed_2n6n 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 138.0 186.0 . . 10 CYSS . . . . . . . . . . . . . parsed_2n6n 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.0 -40.0 . . 11 HIS . . . . . . . . . . . . . parsed_2n6n 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.0 5.0 . . 11 HIS . . . . . . . . . . . . . parsed_2n6n 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.0 -63.0 . . 12 ASN . . . . . . . . . . . . . parsed_2n6n 1
20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.0 31.0 . . 12 ASN . . . . . . . . . . . . . parsed_2n6n 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -188.0 -72.0 . . 13 ILE . . . . . . . . . . . . . parsed_2n6n 1
22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.0 179.0 . . 13 ILE . . . . . . . . . . . . . parsed_2n6n 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -177.0 -41.0 . . 14 HIS . . . . . . . . . . . . . parsed_2n6n 1
24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.0 156.0 . . 14 HIS . . . . . . . . . . . . . parsed_2n6n 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.0 -24.0 . . 15 CYSS . . . . . . . . . . . . . parsed_2n6n 1
26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.0 149.0 . . 15 CYSS . . . . . . . . . . . . . parsed_2n6n 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -97.0 -37.0 . . 17 SER . . . . . . . . . . . . . parsed_2n6n 1
28 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.0 157.0 . . 17 SER . . . . . . . . . . . . . parsed_2n6n 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 63.0 115.0 . . 18 GLY . . . . . . . . . . . . . parsed_2n6n 1
30 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.0 10.0 . . 18 GLY . . . . . . . . . . . . . parsed_2n6n 1
31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.0 -65.0 . . 19 LEU . . . . . . . . . . . . . parsed_2n6n 1
32 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.0 173.0 . . 19 LEU . . . . . . . . . . . . . parsed_2n6n 1
33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.0 -93.0 . . 20 THR . . . . . . . . . . . . . parsed_2n6n 1
34 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.0 153.0 . . 20 THR . . . . . . . . . . . . . parsed_2n6n 1
35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.0 -45.0 . . 21 CYSS . . . . . . . . . . . . . parsed_2n6n 1
36 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 87.0 147.0 . . 21 CYSS . . . . . . . . . . . . . parsed_2n6n 1
37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.0 -82.0 . . 22 LYS . . . . . . . . . . . . . parsed_2n6n 1
38 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.0 149.0 . . 22 LYS . . . . . . . . . . . . . parsed_2n6n 1
39 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.0 -82.0 . . 23 CYSS . . . . . . . . . . . . . parsed_2n6n 1
40 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 154.0 . . 23 CYSS . . . . . . . . . . . . . parsed_2n6n 1
41 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.0 -78.0 . . 24 LYS . . . . . . . . . . . . . parsed_2n6n 1
42 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 76.0 148.0 . . 24 LYS . . . . . . . . . . . . . parsed_2n6n 1
43 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 49.0 89.0 . . 25 GLY . . . . . . . . . . . . . parsed_2n6n 1
44 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.0 -113.0 . . 25 GLY . . . . . . . . . . . . . parsed_2n6n 1
45 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.0 -85.0 . . 26 SER . . . . . . . . . . . . . parsed_2n6n 1
46 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.0 30.0 . . 26 SER . . . . . . . . . . . . . parsed_2n6n 1
47 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.0 -81.0 . . 27 SER . . . . . . . . . . . . . parsed_2n6n 1
48 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.0 152.0 . . 27 SER . . . . . . . . . . . . . parsed_2n6n 1
49 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 -80.0 . . 28 CYSS . . . . . . . . . . . . . parsed_2n6n 1
50 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.0 169.0 . . 28 CYSS . . . . . . . . . . . . . parsed_2n6n 1
51 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.0 -94.0 . . 29 VAL . . . . . . . . . . . . . parsed_2n6n 1
52 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.0 184.0 . . 29 VAL . . . . . . . . . . . . . parsed_2n6n 1
53 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -123.0 -75.0 . . 30 CYSS . . . . . . . . . . . . . parsed_2n6n 1
54 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.0 151.0 . . 30 CYSS . . . . . . . . . . . . . parsed_2n6n 1
55 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.0 -82.0 . . 31 ARG . . . . . . . . . . . . . parsed_2n6n 1
56 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.0 166.0 . . 31 ARG . . . . . . . . . . . . . parsed_2n6n 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 "9 LYS PHI -109.0 -57.0 1.00 #" 15 2 15 40 parsed_2n6n 1
2 "9 LYS PSI -68.0 12.0 1.00 #" 16 2 16 40 parsed_2n6n 1
stop_
save_
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