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 |
|
|
37488 |
1pp5   |
5859 | cing | 2-parsed | STAR | dihedral angle | 13 |
data_1pp5_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1pp5
_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_1pp5 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1pp5
_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 1pp5 "Master copy" parsed_1pp5
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1pp5
_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 1pp5.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1pp5 1
1 1pp5.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1pp5 1
1 1pp5.mr . . DYANA/DIANA 3 distance NOE simple 303 parsed_1pp5 1
1 1pp5.mr . . DYANA/DIANA 4 distance "general distance" simple 11 parsed_1pp5 1
1 1pp5.mr . . unknown 5 distance "hydrogen bond" simple 0 parsed_1pp5 1
1 1pp5.mr . . DYANA/DIANA 6 "dihedral angle" "Not applicable" "Not applicable" 13 parsed_1pp5 1
1 1pp5.mr . . n/a 7 comment "Not applicable" "Not applicable" 0 parsed_1pp5 1
1 1pp5.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1pp5 1
stop_
save_
save_DYANA/DIANA_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1pp5
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 6
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 65.0 . . 3 ALA . . . . . . . . . . . . . parsed_1pp5 1
2 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.0 -95.0 . . 5 HIS . . . . . . . . . . . . . parsed_1pp5 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 6 VAL . . . . . . . . . . . . . parsed_1pp5 1
4 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 8 GLU . . . . . . . . . . . . . parsed_1pp5 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 70.0 . . 9 TYR . . . . . . . . . . . . . parsed_1pp5 1
6 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 10 PHE . . . . . . . . . . . . . parsed_1pp5 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 75.0 . . 11 VAL . . . . . . . . . . . . . parsed_1pp5 1
8 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 80.0 . . 13 ILE . . . . . . . . . . . . . parsed_1pp5 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 75.0 . . 15 THR . . . . . . . . . . . . . parsed_1pp5 1
10 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 17 ILE . . . . . . . . . . . . . parsed_1pp5 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.0 90.0 . . 18 SER . . . . . . . . . . . . . parsed_1pp5 1
12 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.0 -95.0 . . 19 PHE . . . . . . . . . . . . . parsed_1pp5 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 75.0 . . 20 TYR . . . . . . . . . . . . . parsed_1pp5 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 "Dihedral Angle Constraints derived from HNHA experiment" 2 1 2 57 parsed_1pp5 1
2 "-- Angle constraint file built by HYPER -- DIANA | DYANA format" 3 1 3 67 parsed_1pp5 1
3 "-- from data in file MCCJ25.hyp" 4 1 4 35 parsed_1pp5 1
4 "-- Version: 3.1 2001/03/21[Linux] (Compiled on: troberto.cabm.rutgers.edu)" 5 1 5 78 parsed_1pp5 1
5 "END of Dihedral Angle Constraints" 19 1 19 35 parsed_1pp5 1
stop_
save_
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