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 |
|
|
51143 |
2k5p   |
15844 | cing | 2-parsed | STAR | dihedral angle | 38 |
data_2k5p_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k5p
_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_2k5p 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k5p
_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 2k5p "Master copy" parsed_2k5p
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k5p
_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 2k5p.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k5p 1
1 2k5p.mr . . DYANA/DIANA 2 "dihedral angle" "Not applicable" "Not applicable" 38 parsed_2k5p 1
1 2k5p.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2k5p 1
1 2k5p.mr . . DYANA/DIANA 4 distance NOE simple 0 parsed_2k5p 1
1 2k5p.mr . . DYANA/DIANA 5 distance "hydrogen bond" simple 0 parsed_2k5p 1
1 2k5p.mr . . XPLOR/CNS 6 distance NOE simple 0 parsed_2k5p 1
1 2k5p.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k5p 1
stop_
save_
save_DYANA/DIANA_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2k5p
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 3 LEU . . . . . . . . . . . . . parsed_2k5p 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 3 LEU . . . . . . . . . . . . . parsed_2k5p 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 4 THR . . . . . . . . . . . . . parsed_2k5p 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 4 THR . . . . . . . . . . . . . parsed_2k5p 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 5 VAL . . . . . . . . . . . . . parsed_2k5p 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 5 VAL . . . . . . . . . . . . . parsed_2k5p 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 10 SER . . . . . . . . . . . . . parsed_2k5p 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 10 SER . . . . . . . . . . . . . parsed_2k5p 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 11 THR . . . . . . . . . . . . . parsed_2k5p 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 11 THR . . . . . . . . . . . . . parsed_2k5p 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 18 LEU . . . . . . . . . . . . . parsed_2k5p 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 18 LEU . . . . . . . . . . . . . parsed_2k5p 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 19 ASN . . . . . . . . . . . . . parsed_2k5p 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 19 ASN . . . . . . . . . . . . . parsed_2k5p 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -30.0 . . 20 VAL . . . . . . . . . . . . . parsed_2k5p 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 5.0 . . 20 VAL . . . . . . . . . . . . . parsed_2k5p 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -30.0 . . 21 THR . . . . . . . . . . . . . parsed_2k5p 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 5.0 . . 21 THR . . . . . . . . . . . . . parsed_2k5p 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -30.0 . . 22 GLU . . . . . . . . . . . . . parsed_2k5p 1
20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 5.0 . . 22 GLU . . . . . . . . . . . . . parsed_2k5p 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -30.0 . . 23 LEU . . . . . . . . . . . . . parsed_2k5p 1
22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 5.0 . . 23 LEU . . . . . . . . . . . . . parsed_2k5p 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -30.0 . . 24 LEU . . . . . . . . . . . . . parsed_2k5p 1
24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 5.0 . . 24 LEU . . . . . . . . . . . . . parsed_2k5p 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -30.0 . . 25 SER . . . . . . . . . . . . . parsed_2k5p 1
26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 5.0 . . 25 SER . . . . . . . . . . . . . parsed_2k5p 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -30.0 . . 26 ALA . . . . . . . . . . . . . parsed_2k5p 1
28 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 5.0 . . 26 ALA . . . . . . . . . . . . . parsed_2k5p 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 53 THR . . . . . . . . . . . . . parsed_2k5p 1
30 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 53 THR . . . . . . . . . . . . . parsed_2k5p 1
31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 54 VAL . . . . . . . . . . . . . parsed_2k5p 1
32 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 54 VAL . . . . . . . . . . . . . parsed_2k5p 1
33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 59 ALA . . . . . . . . . . . . . parsed_2k5p 1
34 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 59 ALA . . . . . . . . . . . . . parsed_2k5p 1
35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 60 VAL . . . . . . . . . . . . . parsed_2k5p 1
36 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 60 VAL . . . . . . . . . . . . . parsed_2k5p 1
37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 -70.0 . . 61 GLU . . . . . . . . . . . . . parsed_2k5p 1
38 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 180.0 . . 61 GLU . . . . . . . . . . . . . parsed_2k5p 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 "-- Angle constraint file built by HYPER -- DIANA | DYANA format" 1 1 1 67 parsed_2k5p 1
2 "-- from data in file GmR137.hyp" 2 1 2 35 parsed_2k5p 1
3 "-- Version: 3.2 2002/04/18[Linux] (Compiled on: troberto.quifis.uv.es)" 3 1 3 74 parsed_2k5p 1
stop_
save_
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