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 |
|
|
505389 |
2yqq   |
cing | 2-parsed | STAR | dihedral angle | 34 |
data_2yqq_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2yqq
_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_2yqq 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2yqq
_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 2yqq "Master copy" parsed_2yqq
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2yqq
_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 2yqq.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2yqq 1
1 2yqq.mr . . DYANA/DIANA 2 distance "general distance" simple 27 parsed_2yqq 1
1 2yqq.mr . . DYANA/DIANA 3 distance "general distance" simple 27 parsed_2yqq 1
1 2yqq.mr . . DYANA/DIANA 4 "dihedral angle" "Not applicable" "Not applicable" 34 parsed_2yqq 1
1 2yqq.mr . . DYANA/DIANA 5 distance NOE simple 0 parsed_2yqq 1
1 2yqq.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2yqq 1
stop_
save_
save_DYANA/DIANA_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2yqq
_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 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.2 -97.2 . . 14 VAL . . . . . . . . . . . . . parsed_2yqq 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.8 181.8 . . 14 VAL . . . . . . . . . . . . . parsed_2yqq 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.7 -88.7 . . 24 TYR . . . . . . . . . . . . . parsed_2yqq 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.9 174.9 . . 24 TYR . . . . . . . . . . . . . parsed_2yqq 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.8 -84.8 . . 25 ARG . . . . . . . . . . . . . parsed_2yqq 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.2 163.2 . . 25 ARG . . . . . . . . . . . . . parsed_2yqq 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.1 -67.1 . . 31 VAL . . . . . . . . . . . . . parsed_2yqq 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.6 170.6 . . 31 VAL . . . . . . . . . . . . . parsed_2yqq 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.1 -96.1 . . 33 TYR . . . . . . . . . . . . . parsed_2yqq 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.5 173.5 . . 33 TYR . . . . . . . . . . . . . parsed_2yqq 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.7 -55.7 . . 35 SER . . . . . . . . . . . . . parsed_2yqq 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.4 185.4 . . 35 SER . . . . . . . . . . . . . parsed_2yqq 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.2 -30.2 . . 36 VAL . . . . . . . . . . . . . parsed_2yqq 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.0 -4.0 . . 36 VAL . . . . . . . . . . . . . parsed_2yqq 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.6 -32.6 . . 37 VAL . . . . . . . . . . . . . parsed_2yqq 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.4 -11.4 . . 37 VAL . . . . . . . . . . . . . parsed_2yqq 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.7 -32.7 . . 39 PHE . . . . . . . . . . . . . parsed_2yqq 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.9 -15.9 . . 39 PHE . . . . . . . . . . . . . parsed_2yqq 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.1 -30.1 . . 40 ARG . . . . . . . . . . . . . parsed_2yqq 1
20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.9 -12.9 . . 40 ARG . . . . . . . . . . . . . parsed_2yqq 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.3 -38.3 . . 41 LYS . . . . . . . . . . . . . parsed_2yqq 1
22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.2 -6.2 . . 41 LYS . . . . . . . . . . . . . parsed_2yqq 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.3 -35.3 . . 42 HIS . . . . . . . . . . . . . parsed_2yqq 1
24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.4 -11.4 . . 42 HIS . . . . . . . . . . . . . parsed_2yqq 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.4 -33.4 . . 43 LYS . . . . . . . . . . . . . parsed_2yqq 1
26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.6 -9.6 . . 43 LYS . . . . . . . . . . . . . parsed_2yqq 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.5 -38.5 . . 44 GLU . . . . . . . . . . . . . parsed_2yqq 1
28 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.8 -1.8 . . 44 GLU . . . . . . . . . . . . . parsed_2yqq 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.5 -69.5 . . 45 GLN . . . . . . . . . . . . . parsed_2yqq 1
30 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -33.5 26.5 . . 45 GLN . . . . . . . . . . . . . parsed_2yqq 1
31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.4 -59.4 . . 47 ASN . . . . . . . . . . . . . parsed_2yqq 1
32 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.1 161.1 . . 47 ASN . . . . . . . . . . . . . parsed_2yqq 1
33 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 31 VAL . . . . . . . . . . . . . parsed_2yqq 1
34 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 37 VAL . . . . . . . . . . . . . parsed_2yqq 1
stop_
save_
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