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 |
|
|
461031 |
2dl5   |
11222 | cing | 2-parsed | STAR | dihedral angle | 28 |
data_2dl5_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2dl5
_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_2dl5 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2dl5
_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 2dl5 "Master copy" parsed_2dl5
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2dl5
_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 2dl5.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2dl5 1
1 2dl5.mr . . DYANA/DIANA 2 "dihedral combo" ambi "Not applicable" 0 parsed_2dl5 1
1 2dl5.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 303 parsed_2dl5 1
1 2dl5.mr . . DYANA/DIANA 4 distance NOE simple 1480 parsed_2dl5 1
1 2dl5.mr . . DYANA/DIANA 5 "dihedral angle" "Not applicable" "Not applicable" 28 parsed_2dl5 1
1 2dl5.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2dl5 1
stop_
save_
save_DYANA/DIANA_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2dl5
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.2 -101.2 . . 14 LEU . . . . . . . . . . . . . parsed_2dl5 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.0 161.0 . . 14 LEU . . . . . . . . . . . . . parsed_2dl5 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.7 -68.7 . . 15 THR . . . . . . . . . . . . . parsed_2dl5 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.9 160.9 . . 15 THR . . . . . . . . . . . . . parsed_2dl5 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.0 -98.0 . . 16 CYS . . . . . . . . . . . . . parsed_2dl5 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.5 179.5 . . 16 CYS . . . . . . . . . . . . . parsed_2dl5 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.2 -92.2 . . 17 LYS . . . . . . . . . . . . . parsed_2dl5 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.0 166.0 . . 17 LYS . . . . . . . . . . . . . parsed_2dl5 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.7 -73.7 . . 37 VAL . . . . . . . . . . . . . parsed_2dl5 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.9 154.9 . . 37 VAL . . . . . . . . . . . . . parsed_2dl5 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 38 LEU . . . . . . . . . . . . . parsed_2dl5 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.0 184.0 . . 38 LEU . . . . . . . . . . . . . parsed_2dl5 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -154.1 -94.1 . . 39 GLU . . . . . . . . . . . . . parsed_2dl5 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.3 162.3 . . 39 GLU . . . . . . . . . . . . . parsed_2dl5 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.6 -102.6 . . 50 VAL . . . . . . . . . . . . . parsed_2dl5 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.7 182.7 . . 50 VAL . . . . . . . . . . . . . parsed_2dl5 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.3 -99.3 . . 51 LYS . . . . . . . . . . . . . parsed_2dl5 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.5 169.5 . . 51 LYS . . . . . . . . . . . . . parsed_2dl5 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.0 -99.0 . . 52 ALA . . . . . . . . . . . . . parsed_2dl5 1
20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.2 176.2 . . 52 ALA . . . . . . . . . . . . . parsed_2dl5 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.7 -93.7 . . 53 ARG . . . . . . . . . . . . . parsed_2dl5 1
22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.7 164.7 . . 53 ARG . . . . . . . . . . . . . parsed_2dl5 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.3 -95.3 . . 59 VAL . . . . . . . . . . . . . parsed_2dl5 1
24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.1 178.1 . . 59 VAL . . . . . . . . . . . . . parsed_2dl5 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.8 -82.8 . . 61 TYR . . . . . . . . . . . . . parsed_2dl5 1
26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.1 172.1 . . 61 TYR . . . . . . . . . . . . . parsed_2dl5 1
27 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90 -30 . . 38 LEU . . . . . . . . . . . . . parsed_2dl5 1
28 CHI2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150 210 . . 38 LEU . . . . . . . . . . . . . parsed_2dl5 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 "64 GLU PHI -86.3 -26.3" 27 2 27 25 parsed_2dl5 1
2 "64 GLU PSI -61.5 -1.5" 28 2 28 25 parsed_2dl5 1
3 "65 LYS PHI -105.3 -45.3" 29 2 29 26 parsed_2dl5 1
4 "65 LYS PSI -41.9 18.1" 30 2 30 25 parsed_2dl5 1
stop_
save_
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