NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
474330 |
2kuz   |
cing | 2-parsed | STAR | dipolar coupling | 24 |
data_2kuz_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kuz
_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_2kuz 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kuz
_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 2kuz "Master copy" parsed_2kuz
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kuz
_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 2kuz.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kuz 1
1 2kuz.mr . . XPLOR/CNS 2 "dipolar coupling" "Not applicable" "Not applicable" 24 parsed_2kuz 1
1 2kuz.mr . . XPLOR/CNS 3 planarity "Not applicable" "Not applicable" 0 parsed_2kuz 1
1 2kuz.mr . . XPLOR/CNS 4 distance NOE simple 0 parsed_2kuz 1
1 2kuz.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 0 parsed_2kuz 1
1 2kuz.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2kuz 1
1 2kuz.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kuz 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_2
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2kuz
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 2
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint.ID
_RDC_constraint.Assembly_atom_ID_1
_RDC_constraint.Entity_assembly_ID_1
_RDC_constraint.Entity_ID_1
_RDC_constraint.Comp_index_ID_1
_RDC_constraint.Seq_ID_1
_RDC_constraint.Comp_ID_1
_RDC_constraint.Atom_ID_1
_RDC_constraint.Resonance_ID_1
_RDC_constraint.Assembly_atom_ID_2
_RDC_constraint.Entity_assembly_ID_2
_RDC_constraint.Entity_ID_2
_RDC_constraint.Comp_index_ID_2
_RDC_constraint.Seq_ID_2
_RDC_constraint.Comp_ID_2
_RDC_constraint.Atom_ID_2
_RDC_constraint.Resonance_ID_2
_RDC_constraint.RDC_val
_RDC_constraint.RDC_lower_bound
_RDC_constraint.RDC_upper_bound
_RDC_constraint.RDC_val_err
_RDC_constraint.Source_experiment_ID
_RDC_constraint.Auth_asym_ID_1
_RDC_constraint.Auth_seq_ID_1
_RDC_constraint.Auth_comp_ID_1
_RDC_constraint.Auth_atom_ID_1
_RDC_constraint.Auth_asym_ID_2
_RDC_constraint.Auth_seq_ID_2
_RDC_constraint.Auth_comp_ID_2
_RDC_constraint.Auth_atom_ID_2
_RDC_constraint.Entry_ID
_RDC_constraint.RDC_constraint_list_ID
1 . . . . . . . . . . . . . . . . 24.000 23.400 24.600 . . . 6 . C2 . 6 . H2 parsed_2kuz 1
2 . . . . . . . . . . . . . . . . 21.000 20.400 21.600 . . . 7 . C2 . 7 . H2 parsed_2kuz 1
3 . . . . . . . . . . . . . . . . 20.400 19.800 21.000 . . . 8 . C2 . 8 . H2 parsed_2kuz 1
4 . . . . . . . . . . . . . . . . 12.000 11.400 12.600 . . . 16 . C2 . 16 . H2 parsed_2kuz 1
5 . . . . . . . . . . . . . . . . 22.800 22.200 23.400 . . . 24 . C2 . 24 . H2 parsed_2kuz 1
6 . . . . . . . . . . . . . . . . 18.600 18.000 19.200 . . . 9 . C5 . 9 . H5 parsed_2kuz 1
7 . . . . . . . . . . . . . . . . 13.200 12.600 13.800 . . . 17 . C5 . 17 . H5 parsed_2kuz 1
8 . . . . . . . . . . . . . . . . 12.000 11.400 12.600 . . . 3 . C1' . 3 . H1' parsed_2kuz 1
9 . . . . . . . . . . . . . . . . 7.200 6.600 7.800 . . . 9 . C1' . 9 . H1' parsed_2kuz 1
10 . . . . . . . . . . . . . . . . 4.200 3.600 4.800 . . . 17 . C1' . 17 . H1' parsed_2kuz 1
11 . . . . . . . . . . . . . . . . 14.400 13.800 15.000 . . . 20 . C1' . 20 . H1' parsed_2kuz 1
12 . . . . . . . . . . . . . . . . 20.400 19.800 21.000 . . . 21 . C1' . 21 . H1' parsed_2kuz 1
13 . . . . . . . . . . . . . . . . 18.000 17.400 18.600 . . . 3 . C6 . 3 . H6 parsed_2kuz 1
14 . . . . . . . . . . . . . . . . 21.000 20.400 21.600 . . . 5 . C6 . 5 . H6 parsed_2kuz 1
15 . . . . . . . . . . . . . . . . 15.600 15.000 16.200 . . . 20 . C6 . 20 . H6 parsed_2kuz 1
16 . . . . . . . . . . . . . . . . 15.000 14.400 15.600 . . . 21 . C6 . 21 . H6 parsed_2kuz 1
17 . . . . . . . . . . . . . . . . 25.200 24.600 25.800 . . . 23 . C6 . 23 . H6 parsed_2kuz 1
18 . . . . . . . . . . . . . . . . 22.800 22.200 23.400 . . . 7 . C8 . 7 . H8 parsed_2kuz 1
19 . . . . . . . . . . . . . . . . 17.400 16.800 18.000 . . . 16 . C8 . 16 . H8 parsed_2kuz 1
20 . . . . . . . . . . . . . . . . -4.200 -4.800 -3.600 . . . 3 . C5 . 3 . C7 parsed_2kuz 1
21 . . . . . . . . . . . . . . . . -7.200 -7.800 -6.600 . . . 11 . C5 . 11 . C7 parsed_2kuz 1
22 . . . . . . . . . . . . . . . . -10.200 -10.800 -9.600 . . . 19 . C5 . 19 . C7 parsed_2kuz 1
23 . . . . . . . . . . . . . . . . -9.000 -9.600 -8.400 . . . 20 . C5 . 20 . C7 parsed_2kuz 1
24 . . . . . . . . . . . . . . . . -8.400 -9.000 -7.800 . . . 21 . C5 . 21 . C7 parsed_2kuz 1
stop_
loop_
_RDC_constraint_comment_org.ID
_RDC_constraint_comment_org.Comment_text
_RDC_constraint_comment_org.Comment_begin_line
_RDC_constraint_comment_org.Comment_begin_column
_RDC_constraint_comment_org.Comment_end_line
_RDC_constraint_comment_org.Comment_end_column
_RDC_constraint_comment_org.Entry_ID
_RDC_constraint_comment_org.RDC_constraint_list_ID
1 "RDC table" 1 1 1 12 parsed_2kuz 1
2 "RDC table" 154 1 154 12 parsed_2kuz 1
stop_
save_
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