Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
609322 | 5ij4 RC | 30030 | cing | 2-parsed | STAR | dihedral angle | 63 |
data_5ij4_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5ij4
_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_5ij4 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5ij4
_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 5ij4 "Master copy" parsed_5ij4
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5ij4
_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 5ij4.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5ij4 1
1 5ij4.mr . . DYANA/DIANA 2 "dihedral angle" "Not applicable" "Not applicable" 63 parsed_5ij4 1
1 5ij4.mr . . DYANA/DIANA 3 distance "general distance" simple 0 parsed_5ij4 1
1 5ij4.mr . . DYANA/DIANA 4 distance NOE simple 0 parsed_5ij4 1
1 5ij4.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5ij4 1
stop_
save_
save_DYANA/DIANA_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_5ij4
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 2
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.0 -79.0 . . 16 LYS . . . . . . . . . . . . . parsed_5ij4 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 174.0 . . 16 LYS . . . . . . . . . . . . . parsed_5ij4 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -141.0 -81.0 . . 17 HIS . . . . . . . . . . . . . parsed_5ij4 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.0 158.0 . . 17 HIS . . . . . . . . . . . . . parsed_5ij4 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -106.0 -46.0 . . 18 CYS . . . . . . . . . . . . . parsed_5ij4 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.0 151.0 . . 18 CYS . . . . . . . . . . . . . parsed_5ij4 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.0 -69.0 . . 20 TYR . . . . . . . . . . . . . parsed_5ij4 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.0 7.0 . . 20 TYR . . . . . . . . . . . . . parsed_5ij4 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.0 -59.0 . . 23 GLN . . . . . . . . . . . . . parsed_5ij4 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 154.0 . . 23 GLN . . . . . . . . . . . . . parsed_5ij4 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 -60.0 . . 24 LEU . . . . . . . . . . . . . parsed_5ij4 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.0 161.0 . . 24 LEU . . . . . . . . . . . . . parsed_5ij4 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.0 -83.0 . . 25 ASP . . . . . . . . . . . . . parsed_5ij4 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.0 164.0 . . 25 ASP . . . . . . . . . . . . . parsed_5ij4 1
15 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.0 170.0 . . 28 PRO . . . . . . . . . . . . . parsed_5ij4 1
16 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.0 -68.0 . . 29 PHE . . . . . . . . . . . . . parsed_5ij4 1
17 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.0 150.0 . . 29 PHE . . . . . . . . . . . . . parsed_5ij4 1
18 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.0 -72.0 . . 30 HIS . . . . . . . . . . . . . parsed_5ij4 1
19 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.0 139.0 . . 30 HIS . . . . . . . . . . . . . parsed_5ij4 1
20 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.0 -86.0 . . 31 CYS . . . . . . . . . . . . . parsed_5ij4 1
21 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.0 142.0 . . 31 CYS . . . . . . . . . . . . . parsed_5ij4 1
22 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -117.0 -57.0 . . 33 PHE . . . . . . . . . . . . . parsed_5ij4 1
23 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.0 -15.0 . . 33 PHE . . . . . . . . . . . . . parsed_5ij4 1
24 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.0 -78.0 . . 34 CYS . . . . . . . . . . . . . parsed_5ij4 1
25 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.0 10.0 . . 34 CYS . . . . . . . . . . . . . parsed_5ij4 1
26 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 42.0 90.0 . . 35 ASN . . . . . . . . . . . . . parsed_5ij4 1
27 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 60.0 . . 35 ASN . . . . . . . . . . . . . parsed_5ij4 1
28 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.0 -92.0 . . 36 GLU . . . . . . . . . . . . . parsed_5ij4 1
29 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 129.0 189.0 . . 36 GLU . . . . . . . . . . . . . parsed_5ij4 1
30 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.0 -98.0 . . 37 ASP . . . . . . . . . . . . . parsed_5ij4 1
31 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 136.0 164.0 . . 37 ASP . . . . . . . . . . . . . parsed_5ij4 1
32 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168.0 -112.0 . . 38 PHE . . . . . . . . . . . . . parsed_5ij4 1
33 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 133.0 169.0 . . 38 PHE . . . . . . . . . . . . . parsed_5ij4 1
34 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.0 -51.0 . . 40 SER . . . . . . . . . . . . . parsed_5ij4 1
35 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.0 -22.0 . . 40 SER . . . . . . . . . . . . . parsed_5ij4 1
36 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.0 -52.0 . . 41 ASN . . . . . . . . . . . . . parsed_5ij4 1
37 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.0 -2.0 . . 41 ASN . . . . . . . . . . . . . parsed_5ij4 1
38 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.0 -61.0 . . 42 HIS . . . . . . . . . . . . . parsed_5ij4 1
39 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.0 19.0 . . 42 HIS . . . . . . . . . . . . . parsed_5ij4 1
40 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.0 -41.0 . . 43 ARG . . . . . . . . . . . . . parsed_5ij4 1
41 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.0 -14.0 . . 43 ARG . . . . . . . . . . . . . parsed_5ij4 1
42 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 -43.0 . . 45 LYS . . . . . . . . . . . . . parsed_5ij4 1
43 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.0 -30.0 . . 45 LYS . . . . . . . . . . . . . parsed_5ij4 1
44 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 -55.0 . . 46 GLU . . . . . . . . . . . . . parsed_5ij4 1
45 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.0 -19.0 . . 46 GLU . . . . . . . . . . . . . parsed_5ij4 1
46 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.0 -50.0 . . 47 ASP . . . . . . . . . . . . . parsed_5ij4 1
47 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.0 -5.0 . . 47 ASP . . . . . . . . . . . . . parsed_5ij4 1
48 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.0 -77.0 . . 48 HIS . . . . . . . . . . . . . parsed_5ij4 1
49 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -13.0 19.0 . . 48 HIS . . . . . . . . . . . . . parsed_5ij4 1
50 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 27.0 87.0 . . 49 HIS . . . . . . . . . . . . . parsed_5ij4 1
51 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 17.0 61.0 . . 49 HIS . . . . . . . . . . . . . parsed_5ij4 1
52 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -101.0 -41.0 . . 50 CYS . . . . . . . . . . . . . parsed_5ij4 1
53 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.0 171.0 . . 50 CYS . . . . . . . . . . . . . parsed_5ij4 1
54 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.0 -53.0 . . 51 ARG . . . . . . . . . . . . . parsed_5ij4 1
55 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.0 -9.0 . . 51 ARG . . . . . . . . . . . . . parsed_5ij4 1
56 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.0 -53.0 . . 52 TRP . . . . . . . . . . . . . parsed_5ij4 1
57 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.0 -15.0 . . 52 TRP . . . . . . . . . . . . . parsed_5ij4 1
58 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.0 -49.0 . . 53 LEU . . . . . . . . . . . . . parsed_5ij4 1
59 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.0 -7.0 . . 53 LEU . . . . . . . . . . . . . parsed_5ij4 1
60 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -103.0 -43.0 . . 54 LEU . . . . . . . . . . . . . parsed_5ij4 1
61 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.0 -19.0 . . 54 LEU . . . . . . . . . . . . . parsed_5ij4 1
62 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.0 -58.0 . . 55 GLU . . . . . . . . . . . . . parsed_5ij4 1
63 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.0 5.0 . . 55 GLU . . . . . . . . . . . . . parsed_5ij4 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 "Restraints file 1: final.aco" 1 1 1 30 parsed_5ij4 1
stop_
save_