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 |
|
|
512272 |
2lcy   |
17638 | cing | 2-parsed | STAR | dihedral angle | 20 |
data_2lcy_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lcy
_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_2lcy 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lcy
_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 2lcy "Master copy" parsed_2lcy
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lcy
_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 2lcy.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lcy 1
1 2lcy.mr . . XPLOR/CNS 2 distance NOE simple 517 parsed_2lcy 1
1 2lcy.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 20 parsed_2lcy 1
1 2lcy.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lcy 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2lcy
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.5 -72.5 . . 530 . c . 531 . n . 531 . ca . 531 . c parsed_2lcy 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.9 -25.9 . . 532 . c . 533 . n . 533 . ca . 533 . c parsed_2lcy 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.1 -60.1 . . 534 . c . 535 . n . 535 . ca . 535 . c parsed_2lcy 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.7 -32.7 . . 536 . c . 536 . n . 536 . ca . 536 . c parsed_2lcy 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -99.7 -39.7 . . 536 . c . 538 . n . 538 . ca . 538 . c parsed_2lcy 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.8 -38.8 . . 538 . c . 539 . n . 539 . ca . 539 . c parsed_2lcy 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -101.4 -41.4 . . 541 . c . 542 . n . 542 . ca . 542 . c parsed_2lcy 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.4 -34.4 . . 543 . c . 544 . n . 544 . ca . 544 . c parsed_2lcy 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -109.6 -49.6 . . 553 . c . 554 . n . 554 . ca . 554 . c parsed_2lcy 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -109.8 -49.8 . . 554 . c . 555 . n . 555 . ca . 555 . c parsed_2lcy 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.8 29.2 . . 531 . n . 531 . ca . 531 . c . 532 . n parsed_2lcy 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.1 3.9 . . 534 . n . 534 . ca . 534 . c . 535 . n parsed_2lcy 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.0 20.0 . . 535 . n . 535 . ca . 535 . c . 536 . n parsed_2lcy 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.9 -2.9 . . 536 . n . 536 . ca . 536 . c . 538 . n parsed_2lcy 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.6 2.4 . . 538 . n . 538 . ca . 538 . c . 539 . n parsed_2lcy 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.9 -1.9 . . 539 . n . 539 . ca . 539 . c . 540 . n parsed_2lcy 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.7 -0.7 . . 542 . n . 542 . ca . 542 . c . 543 . n parsed_2lcy 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.3 -10.3 . . 544 . n . 544 . ca . 544 . c . 545 . n parsed_2lcy 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.4 5.6 . . 554 . n . 554 . ca . 554 . c . 555 . n parsed_2lcy 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.8 11.2 . . 555 . n . 555 . ca . 555 . c . 556 . n parsed_2lcy 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 "remark phi angles" 1 1 1 19 parsed_2lcy 1
2 "remark psi angles" 24 1 24 19 parsed_2lcy 1
stop_
save_
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