NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
463322 |
2yra   |
cing | 2-parsed | STAR | dihedral angle | 62 |
data_2yra_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2yra
_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_2yra 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2yra
_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 2yra "Master copy" parsed_2yra
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2yra
_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 2yra.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2yra 1
1 2yra.mr . . DYANA/DIANA 2 "dihedral combo" ambi "Not applicable" 0 parsed_2yra 1
1 2yra.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 252 parsed_2yra 1
1 2yra.mr . . DYANA/DIANA 4 distance NOE simple 643 parsed_2yra 1
1 2yra.mr . . DYANA/DIANA 5 "dihedral angle" "Not applicable" "Not applicable" 62 parsed_2yra 1
1 2yra.mr . . DYANA/DIANA 6 distance NOE simple 0 parsed_2yra 1
1 2yra.mr . . DYANA/DIANA 7 distance "disulfide bond" simple 0 parsed_2yra 1
1 2yra.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2yra 1
stop_
save_
save_DYANA/DIANA_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2yra
_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 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 18 TRP . . . . . . . . . . . . . parsed_2yra 1
2 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 50 CYSS . . . . . . . . . . . . . parsed_2yra 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.4 -59.4 . . 11 LEU . . . . . . . . . . . . . parsed_2yra 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99.3 159.3 . . 11 LEU . . . . . . . . . . . . . parsed_2yra 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.7 -100.7 . . 14 ILE . . . . . . . . . . . . . parsed_2yra 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.8 174.8 . . 14 ILE . . . . . . . . . . . . . parsed_2yra 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.5 -99.5 . . 18 TRP . . . . . . . . . . . . . parsed_2yra 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.2 184.2 . . 18 TRP . . . . . . . . . . . . . parsed_2yra 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.9 -85.9 . . 19 LYS . . . . . . . . . . . . . parsed_2yra 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.2 173.2 . . 19 LYS . . . . . . . . . . . . . parsed_2yra 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.5 -84.5 . . 27 VAL . . . . . . . . . . . . . parsed_2yra 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.5 194.5 . . 27 VAL . . . . . . . . . . . . . parsed_2yra 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 63.2 123.2 . . 29 GLY . . . . . . . . . . . . . parsed_2yra 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42.7 17.3 . . 29 GLY . . . . . . . . . . . . . parsed_2yra 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.4 -105.4 . . 31 ARG . . . . . . . . . . . . . parsed_2yra 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.3 176.3 . . 31 ARG . . . . . . . . . . . . . parsed_2yra 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.2 -92.2 . . 32 ILE . . . . . . . . . . . . . parsed_2yra 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.8 155.8 . . 32 ILE . . . . . . . . . . . . . parsed_2yra 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -141.1 -81.1 . . 33 THR . . . . . . . . . . . . . parsed_2yra 1
20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.5 154.5 . . 33 THR . . . . . . . . . . . . . parsed_2yra 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.8 -96.8 . . 34 TYR . . . . . . . . . . . . . parsed_2yra 1
22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.5 176.5 . . 34 TYR . . . . . . . . . . . . . parsed_2yra 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.2 -98.2 . . 35 GLN . . . . . . . . . . . . . parsed_2yra 1
24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.5 181.5 . . 35 GLN . . . . . . . . . . . . . parsed_2yra 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.2 -98.2 . . 36 CYSS . . . . . . . . . . . . . parsed_2yra 1
26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.4 174.4 . . 36 CYSS . . . . . . . . . . . . . parsed_2yra 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.5 -60.5 . . 37 ASP . . . . . . . . . . . . . parsed_2yra 1
28 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.0 170.0 . . 37 ASP . . . . . . . . . . . . . parsed_2yra 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.8 -72.8 . . 40 TYR . . . . . . . . . . . . . parsed_2yra 1
30 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.3 179.3 . . 40 TYR . . . . . . . . . . . . . parsed_2yra 1
31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.2 -97.2 . . 41 ASP . . . . . . . . . . . . . parsed_2yra 1
32 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.6 169.6 . . 41 ASP . . . . . . . . . . . . . parsed_2yra 1
33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.8 -69.8 . . 42 ILE . . . . . . . . . . . . . parsed_2yra 1
34 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.5 162.5 . . 42 ILE . . . . . . . . . . . . . parsed_2yra 1
35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.8 -68.8 . . 43 VAL . . . . . . . . . . . . . parsed_2yra 1
36 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.9 164.9 . . 43 VAL . . . . . . . . . . . . . parsed_2yra 1
37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.8 -75.8 . . 47 THR . . . . . . . . . . . . . parsed_2yra 1
38 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.2 161.2 . . 47 THR . . . . . . . . . . . . . parsed_2yra 1
39 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.4 -93.4 . . 48 LEU . . . . . . . . . . . . . parsed_2yra 1
40 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.3 166.3 . . 48 LEU . . . . . . . . . . . . . parsed_2yra 1
41 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.8 -84.8 . . 49 THR . . . . . . . . . . . . . parsed_2yra 1
42 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.9 160.9 . . 49 THR . . . . . . . . . . . . . parsed_2yra 1
43 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.5 -92.5 . . 50 CYSS . . . . . . . . . . . . . parsed_2yra 1
44 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.8 165.8 . . 50 CYSS . . . . . . . . . . . . . parsed_2yra 1
45 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.4 -30.4 . . 52 TRP . . . . . . . . . . . . . parsed_2yra 1
46 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.5 6.4 . . 52 TRP . . . . . . . . . . . . . parsed_2yra 1
47 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -117.6 -57.6 . . 53 ASP . . . . . . . . . . . . . parsed_2yra 1
48 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -27.4 32.6 . . 53 ASP . . . . . . . . . . . . . parsed_2yra 1
49 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 31.2 91.2 . . 54 LEU . . . . . . . . . . . . . parsed_2yra 1
50 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 2.5 62.5 . . 54 LEU . . . . . . . . . . . . . parsed_2yra 1
51 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.5 -52.5 . . 56 TRP . . . . . . . . . . . . . parsed_2yra 1
52 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 129.0 189.0 . . 56 TRP . . . . . . . . . . . . . parsed_2yra 1
53 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.3 -33.3 . . 57 SER . . . . . . . . . . . . . parsed_2yra 1
54 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.5 9.5 . . 57 SER . . . . . . . . . . . . . parsed_2yra 1
55 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.8 -110.8 . . 62 PHE . . . . . . . . . . . . . parsed_2yra 1
56 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.3 185.3 . . 62 PHE . . . . . . . . . . . . . parsed_2yra 1
57 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.7 -101.7 . . 63 CYSS . . . . . . . . . . . . . parsed_2yra 1
58 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.1 173.1 . . 63 CYSS . . . . . . . . . . . . . parsed_2yra 1
59 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.6 -95.6 . . 64 GLU . . . . . . . . . . . . . parsed_2yra 1
60 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.4 156.4 . . 64 GLU . . . . . . . . . . . . . parsed_2yra 1
61 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -102.5 -42.5 . . 65 LYS . . . . . . . . . . . . . parsed_2yra 1
62 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.3 165.3 . . 65 LYS . . . . . . . . . . . . . parsed_2yra 1
stop_
save_
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