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 |
|
|
32700 |
1gks   |
cing | 2-parsed | STAR | dihedral angle | 11 |
data_1gks_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1gks
_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_1gks 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1gks
_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 1gks "Master copy" parsed_1gks
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1gks
_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 1gks.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1gks 1
1 1gks.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1gks 1
1 1gks.mr . . DISCOVER 3 distance NOE simple 873 parsed_1gks 1
1 1gks.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1gks 1
1 1gks.mr . . DISCOVER 5 distance NOE simple 263 parsed_1gks 1
1 1gks.mr . . DISCOVER 6 distance NOE simple 35 parsed_1gks 1
1 1gks.mr . . DISCOVER 7 distance NOE simple 86 parsed_1gks 1
1 1gks.mr . . DISCOVER 8 distance NOE simple 188 parsed_1gks 1
1 1gks.mr . . n/a 9 comment "Not applicable" "Not applicable" 0 parsed_1gks 1
1 1gks.mr . . DISCOVER 10 "dihedral angle" "Not applicable" "Not applicable" 11 parsed_1gks 1
1 1gks.mr . . n/a 11 comment "Not applicable" "Not applicable" 0 parsed_1gks 1
stop_
save_
save_Discover_dihedral_10
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1gks
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 10
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -30.0 . 1 6 TYR N 1 6 TYR CA 1 6 TYR CB 1 6 TYR CG parsed_1gks 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . 1 17 CYS N 1 17 CYS CA 1 17 CYS CB 1 17 CYS SG parsed_1gks 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . 1 18 HIZ N 1 18 HIZ CA 1 18 HIZ CB 1 18 HIZ CG parsed_1gks 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . 1 34 TRP N 1 34 TRP CA 1 34 TRP CB 1 34 TRP CG parsed_1gks 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . 1 36 ASX N 1 36 ASX CA 1 36 ASX CB 1 36 ASX CG parsed_1gks 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . 1 40 SER N 1 40 SER CA 1 40 SER CB 1 40 SER OG parsed_1gks 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 90.0 . 1 47 SER N 1 47 SER CA 1 47 SER CB 1 47 SER OG parsed_1gks 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 59 ASX N 1 59 ASX CA 1 59 ASX CB 1 59 ASX CG parsed_1gks 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . 1 66 ASX N 1 66 ASX CA 1 66 ASX CB 1 66 ASX CG parsed_1gks 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . 1 58 TYR N 1 58 TYR CA 1 58 TYR CB 1 58 TYR CG parsed_1gks 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 -150.0 . 1 73 TYR N 1 73 TYR CA 1 73 TYR CB 1 73 TYR CG parsed_1gks 1
stop_
save_
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