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 |
|
|
51937 |
2kbv   |
16056 | cing | 2-parsed | STAR | dihedral angle | 28 |
data_2kbv_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kbv
_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_2kbv 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kbv
_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 2kbv "Master copy" parsed_2kbv
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kbv
_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 2kbv.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kbv 1
1 2kbv.mr . . XPLOR/CNS 2 distance NOE ambi 622 parsed_2kbv 1
1 2kbv.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 28 parsed_2kbv 1
1 2kbv.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kbv 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2kbv
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 448 . C . 449 . N . 449 . CA . 449 . C parsed_2kbv 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 449 . N . 449 . CA . 449 . C . 450 . N parsed_2kbv 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 449 . C . 450 . N . 450 . CA . 450 . C parsed_2kbv 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 450 . N . 450 . CA . 450 . C . 451 . N parsed_2kbv 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 450 . C . 451 . N . 451 . CA . 451 . C parsed_2kbv 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 451 . N . 451 . CA . 451 . C . 452 . N parsed_2kbv 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 451 . C . 452 . N . 452 . CA . 452 . C parsed_2kbv 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 452 . N . 452 . CA . 452 . C . 453 . N parsed_2kbv 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 452 . C . 453 . N . 453 . CA . 453 . C parsed_2kbv 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 453 . N . 453 . CA . 453 . C . 454 . N parsed_2kbv 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 460 . C . 461 . N . 461 . CA . 461 . C parsed_2kbv 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 461 . N . 461 . CA . 461 . C . 462 . N parsed_2kbv 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 461 . C . 462 . N . 462 . CA . 462 . C parsed_2kbv 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 462 . N . 462 . CA . 462 . C . 463 . N parsed_2kbv 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 462 . C . 463 . N . 463 . CA . 463 . C parsed_2kbv 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 463 . N . 463 . CA . 463 . C . 464 . N parsed_2kbv 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 463 . C . 464 . N . 464 . CA . 464 . C parsed_2kbv 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 464 . N . 464 . CA . 464 . C . 465 . N parsed_2kbv 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 464 . C . 465 . N . 465 . CA . 465 . C parsed_2kbv 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 465 . N . 465 . CA . 465 . C . 466 . N parsed_2kbv 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 465 . C . 466 . N . 466 . CA . 466 . C parsed_2kbv 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 466 . N . 466 . CA . 466 . C . 467 . N parsed_2kbv 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 466 . C . 467 . N . 467 . CA . 467 . C parsed_2kbv 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 467 . N . 467 . CA . 467 . C . 468 . N parsed_2kbv 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 467 . C . 468 . N . 468 . CA . 468 . C parsed_2kbv 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 468 . N . 468 . CA . 468 . C . 469 . N parsed_2kbv 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . . 468 . C . 469 . N . 469 . CA . 469 . C parsed_2kbv 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 0.00 . . 469 . N . 469 . CA . 469 . C . 470 . N parsed_2kbv 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 "Q 449 Phi Psi" 1 1 1 16 parsed_2kbv 1
2 "F 450 Phi Psi" 6 1 6 16 parsed_2kbv 1
3 "I 451 Phi Psi" 11 1 11 16 parsed_2kbv 1
4 "I 452 Phi Psi" 16 1 16 16 parsed_2kbv 1
5 "A 453 Phi Psi" 21 1 21 16 parsed_2kbv 1
6 "I 461 Phi Psi" 27 1 27 16 parsed_2kbv 1
7 "A 462 Phi Psi" 32 1 32 16 parsed_2kbv 1
8 "F 463 Phi Psi" 37 1 37 16 parsed_2kbv 1
9 "S 464 Phi Psi" 42 1 42 16 parsed_2kbv 1
10 "L 465 Phi Psi" 47 1 47 16 parsed_2kbv 1
11 "G 466 Phi Psi" 52 1 52 16 parsed_2kbv 1
12 "Y 467 Phi Psi" 57 1 57 16 parsed_2kbv 1
13 "L 468 Phi Psi" 62 1 62 16 parsed_2kbv 1
14 "L 469 Phi Psi" 67 1 67 16 parsed_2kbv 1
stop_
save_
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