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 |
|
|
637228 |
6hyk   |
34321 | cing | 2-parsed | STAR | dipolar coupling | 37 |
data_6hyk_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6hyk
_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_6hyk 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6hyk
_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 6hyk "Master copy" parsed_6hyk
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6hyk
_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 6hyk.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6hyk 1
1 6hyk.mr . . XPLOR/CNS 2 distance NOE simple 540 parsed_6hyk 1
1 6hyk.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 241 parsed_6hyk 1
1 6hyk.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 66 parsed_6hyk 1
1 6hyk.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 37 parsed_6hyk 1
1 6hyk.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6hyk 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_6hyk
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 5
_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 . . . . . . . . . . . . . . . . -9.35 . . . . . 2 . C8 . 2 . H8 parsed_6hyk 1
2 . . . . . . . . . . . . . . . . 1.50 . . . . . 4 . C8 . 4 . H8 parsed_6hyk 1
3 . . . . . . . . . . . . . . . . 17.28 . . . . . 5 . C6 . 5 . H6 parsed_6hyk 1
4 . . . . . . . . . . . . . . . . 11.13 . . . . . 6 . C8 . 6 . H8 parsed_6hyk 1
5 . . . . . . . . . . . . . . . . -6.79 . . . . . 7 . C8 . 7 . H8 parsed_6hyk 1
6 . . . . . . . . . . . . . . . . 14.88 . . . . . 8 . C6 . 8 . H6 parsed_6hyk 1
7 . . . . . . . . . . . . . . . . 10.33 . . . . . 9 . C8 . 9 . H8 parsed_6hyk 1
8 . . . . . . . . . . . . . . . . 15.49 . . . . . 10 . C8 . 10 . H8 parsed_6hyk 1
9 . . . . . . . . . . . . . . . . 3.66 . . . . . 11 . C6 . 11 . H6 parsed_6hyk 1
10 . . . . . . . . . . . . . . . . 1.98 . . . . . 12 . C8 . 12 . H8 parsed_6hyk 1
11 . . . . . . . . . . . . . . . . 5.59 . . . . . 13 . C8 . 13 . H8 parsed_6hyk 1
12 . . . . . . . . . . . . . . . . 0.41 . . . . . 16 . C6 . 16 . H6 parsed_6hyk 1
13 . . . . . . . . . . . . . . . . 7.31 . . . . . 17 . C6 . 17 . H6 parsed_6hyk 1
14 . . . . . . . . . . . . . . . . -4.97 . . . . . 18 . C6 . 18 . H6 parsed_6hyk 1
15 . . . . . . . . . . . . . . . . 3.66 . . . . . 19 . C8 . 19 . H8 parsed_6hyk 1
16 . . . . . . . . . . . . . . . . 18.00 . . . . . 20 . C8 . 20 . H8 parsed_6hyk 1
17 . . . . . . . . . . . . . . . . 12.37 . . . . . 24 . C6 . 24 . H6 parsed_6hyk 1
18 . . . . . . . . . . . . . . . . 13.80 . . . . . 25 . C8 . 25 . H8 parsed_6hyk 1
19 . . . . . . . . . . . . . . . . 17.22 . . . . . 26 . C8 . 26 . H8 parsed_6hyk 1
20 . . . . . . . . . . . . . . . . 6.44 . . . . . 28 . C6 . 28 . H6 parsed_6hyk 1
21 . . . . . . . . . . . . . . . . 3.50 . . . . . 29 . C8 . 29 . H8 parsed_6hyk 1
22 . . . . . . . . . . . . . . . . -14.85 . . . . . 4 . C2 . 4 . H2 parsed_6hyk 1
23 . . . . . . . . . . . . . . . . -0.86 . . . . . 10 . C2 . 10 . H2 parsed_6hyk 1
24 . . . . . . . . . . . . . . . . 2.56 . . . . . 13 . C2 . 13 . H2 parsed_6hyk 1
25 . . . . . . . . . . . . . . . . 3.97 . . . . . 6 . C1' . 6 . H1' parsed_6hyk 1
26 . . . . . . . . . . . . . . . . 9.41 . . . . . 9 . C1' . 9 . H1' parsed_6hyk 1
27 . . . . . . . . . . . . . . . . 9.71 . . . . . 13 . C1' . 13 . H1' parsed_6hyk 1
28 . . . . . . . . . . . . . . . . 7.43 . . . . . 17 . C1' . 17 . H1' parsed_6hyk 1
29 . . . . . . . . . . . . . . . . -4.76 . . . . . 19 . C1' . 19 . H1' parsed_6hyk 1
30 . . . . . . . . . . . . . . . . -7.69 . . . . . 2 . N1 . 2 . H1 parsed_6hyk 1
31 . . . . . . . . . . . . . . . . -1.23 . . . . . 12 . N1 . 12 . H1 parsed_6hyk 1
32 . . . . . . . . . . . . . . . . 8.22 . . . . . 19 . N1 . 19 . H1 parsed_6hyk 1
33 . . . . . . . . . . . . . . . . 9.16 . . . . . 20 . N1 . 20 . H1 parsed_6hyk 1
34 . . . . . . . . . . . . . . . . 5.25 . . . . . 21 . N1 . 21 . H1 parsed_6hyk 1
35 . . . . . . . . . . . . . . . . 4.20 . . . . . 22 . N3 . 22 . H3 parsed_6hyk 1
36 . . . . . . . . . . . . . . . . 7.47 . . . . . 27 . N1 . 27 . H1 parsed_6hyk 1
37 . . . . . . . . . . . . . . . . 4.39 . . . . . 28 . N3 . 28 . H3 parsed_6hyk 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
;
RDCs(CH)
;
1 1 6 2 parsed_6hyk 1
2
;
RDCs(NH)
;
36 1 39 2 parsed_6hyk 1
stop_
save_
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