Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
602014 | 2n1p RC | 25570 | cing | 2-parsed | STAR | dihedral angle | 31 |
data_2n1p_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2n1p
_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_2n1p 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2n1p
_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 2n1p "Master copy" parsed_2n1p
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2n1p
_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 2n1p.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2n1p 1
1 2n1p.mr . . XPLOR/CNS 2 distance NOE simple 178 parsed_2n1p 1
1 2n1p.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 31 parsed_2n1p 1
1 2n1p.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2n1p 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2n1p
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.7 -40.7 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_2n1p 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.3 -20.3 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_2n1p 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.5 -42.5 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_2n1p 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.8 -23.8 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_2n1p 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.2 -40.2 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_2n1p 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.8 -25.8 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_2n1p 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.1 -44.1 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_2n1p 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.0 -27.0 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_2n1p 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.8 -43.8 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_2n1p 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.8 -27.8 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_2n1p 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.2 -45.2 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_2n1p 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.2 -24.2 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_2n1p 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.8 -40.8 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_2n1p 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.4 -21.4 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_2n1p 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.0 -42.0 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_2n1p 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.0 -19.0 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_2n1p 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.4 -43.4 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2n1p 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.3 -20.3 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2n1p 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.7 -43.7 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2n1p 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.5 -25.5 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2n1p 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.7 -38.7 . . 22 . C . 23 . N . 23 . CA . 23 . C parsed_2n1p 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.5 -22.5 . . 23 . N . 23 . CA . 23 . C . 24 . N parsed_2n1p 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.9 -45.9 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_2n1p 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.3 -22.3 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_2n1p 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.3 -43.3 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_2n1p 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.8 -22.6 . . 25 . N . 25 . CA . 25 . C . 26 . N parsed_2n1p 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.8 -45.8 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_2n1p 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.8 -5.6 . . 26 . N . 26 . CA . 26 . C . 27 . N parsed_2n1p 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.0 -5.0 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2n1p 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -107.6 -48.8 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2n1p 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -36.6 5.2 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2n1p 1
stop_
loop_
_TA_constraint_parse_err.ID
_TA_constraint_parse_err.Content
_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1 end 64 1 64 3 parsed_2n1p 1
stop_
save_