NMR Restraints Grid
| |
NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
569671 |
2ltr   |
17703 | cing | 2-parsed | STAR | dipolar coupling | 46 |
data_2ltr_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2ltr
_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_2ltr 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2ltr
_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 2ltr "Master copy" parsed_2ltr
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2ltr
_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 2ltr.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2ltr 1
1 2ltr.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 182 parsed_2ltr 1
1 2ltr.mr . . XPLOR/CNS 3 distance NOE simple 416 parsed_2ltr 1
1 2ltr.mr . . XPLOR/CNS 4 distance PRE "Not applicable" 33 parsed_2ltr 1
1 2ltr.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 46 parsed_2ltr 1
1 2ltr.mr . . XPLOR/CNS 6 distance "hydrogen bond" simple 0 parsed_2ltr 1
1 2ltr.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2ltr 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2ltr
_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 . . . . . . . . . . . . . . . . -7.3933 . . . . . 38 . N . 38 . HN parsed_2ltr 1
2 . . . . . . . . . . . . . . . . -0.7734 . . . . . 45 . N . 45 . HN parsed_2ltr 1
3 . . . . . . . . . . . . . . . . 3.2302 . . . . . 46 . N . 46 . HN parsed_2ltr 1
4 . . . . . . . . . . . . . . . . -1.9326 . . . . . 47 . N . 47 . HN parsed_2ltr 1
5 . . . . . . . . . . . . . . . . -1.1391 . . . . . 48 . N . 48 . HN parsed_2ltr 1
6 . . . . . . . . . . . . . . . . -0.7224 . . . . . 49 . N . 49 . HN parsed_2ltr 1
7 . . . . . . . . . . . . . . . . -1.7581 . . . . . 52 . N . 52 . HN parsed_2ltr 1
8 . . . . . . . . . . . . . . . . 3.9365 . . . . . 54 . N . 54 . HN parsed_2ltr 1
9 . . . . . . . . . . . . . . . . -7.4763 . . . . . 55 . N . 55 . HN parsed_2ltr 1
10 . . . . . . . . . . . . . . . . 4.3554 . . . . . 57 . N . 57 . HN parsed_2ltr 1
11 . . . . . . . . . . . . . . . . 7.6626 . . . . . 62 . N . 62 . HN parsed_2ltr 1
12 . . . . . . . . . . . . . . . . 3.9291 . . . . . 63 . N . 63 . HN parsed_2ltr 1
13 . . . . . . . . . . . . . . . . 6.6106 . . . . . 64 . N . 64 . HN parsed_2ltr 1
14 . . . . . . . . . . . . . . . . -2.3637 . . . . . 65 . N . 65 . HN parsed_2ltr 1
15 . . . . . . . . . . . . . . . . 4.4390 . . . . . 66 . N . 66 . HN parsed_2ltr 1
16 . . . . . . . . . . . . . . . . 1.0595 . . . . . 67 . N . 67 . HN parsed_2ltr 1
17 . . . . . . . . . . . . . . . . -1.0899 . . . . . 70 . N . 70 . HN parsed_2ltr 1
18 . . . . . . . . . . . . . . . . -1.1763 . . . . . 71 . N . 71 . HN parsed_2ltr 1
19 . . . . . . . . . . . . . . . . 0.8293 . . . . . 72 . N . 72 . HN parsed_2ltr 1
20 . . . . . . . . . . . . . . . . 4.6408 . . . . . 73 . N . 73 . HN parsed_2ltr 1
21 . . . . . . . . . . . . . . . . 4.1378 . . . . . 74 . N . 74 . HN parsed_2ltr 1
22 . . . . . . . . . . . . . . . . 9.5906 . . . . . 75 . N . 75 . HN parsed_2ltr 1
23 . . . . . . . . . . . . . . . . 8.5818 . . . . . 76 . N . 76 . HN parsed_2ltr 1
24 . . . . . . . . . . . . . . . . 4.4492 . . . . . 77 . N . 77 . HN parsed_2ltr 1
25 . . . . . . . . . . . . . . . . 3.5708 . . . . . 80 . N . 80 . HN parsed_2ltr 1
26 . . . . . . . . . . . . . . . . 8.5183 . . . . . 81 . N . 81 . HN parsed_2ltr 1
27 . . . . . . . . . . . . . . . . 8.0454 . . . . . 82 . N . 82 . HN parsed_2ltr 1
28 . . . . . . . . . . . . . . . . 4.5675 . . . . . 84 . N . 84 . HN parsed_2ltr 1
29 . . . . . . . . . . . . . . . . 4.2362 . . . . . 85 . N . 85 . HN parsed_2ltr 1
30 . . . . . . . . . . . . . . . . 0.7165 . . . . . 86 . N . 86 . HN parsed_2ltr 1
31 . . . . . . . . . . . . . . . . -1.6323 . . . . . 88 . N . 88 . HN parsed_2ltr 1
32 . . . . . . . . . . . . . . . . 0.0905 . . . . . 89 . N . 89 . HN parsed_2ltr 1
33 . . . . . . . . . . . . . . . . -7.6879 . . . . . 91 . N . 91 . HN parsed_2ltr 1
34 . . . . . . . . . . . . . . . . 3.4822 . . . . . 93 . N . 93 . HN parsed_2ltr 1
35 . . . . . . . . . . . . . . . . -3.3980 . . . . . 94 . N . 94 . HN parsed_2ltr 1
36 . . . . . . . . . . . . . . . . -7.5348 . . . . . 99 . N . 99 . HN parsed_2ltr 1
37 . . . . . . . . . . . . . . . . -1.8862 . . . . . 101 . N . 101 . HN parsed_2ltr 1
38 . . . . . . . . . . . . . . . . -8.3589 . . . . . 102 . N . 102 . HN parsed_2ltr 1
39 . . . . . . . . . . . . . . . . -3.9525 . . . . . 103 . N . 103 . HN parsed_2ltr 1
40 . . . . . . . . . . . . . . . . -2.0583 . . . . . 104 . N . 104 . HN parsed_2ltr 1
41 . . . . . . . . . . . . . . . . 1.5300 . . . . . 108 . N . 108 . HN parsed_2ltr 1
42 . . . . . . . . . . . . . . . . -0.8528 . . . . . 121 . N . 121 . HN parsed_2ltr 1
43 . . . . . . . . . . . . . . . . -3.2713 . . . . . 122 . N . 122 . HN parsed_2ltr 1
44 . . . . . . . . . . . . . . . . -1.1660 . . . . . 126 . N . 126 . HN parsed_2ltr 1
45 . . . . . . . . . . . . . . . . -7.9060 . . . . . 129 . N . 129 . HN parsed_2ltr 1
46 . . . . . . . . . . . . . . . . 2.8186 . . . . . 130 . N . 130 . HN parsed_2ltr 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 "! H-bond restraints" 276 53 276 73 parsed_2ltr 1
stop_
save_
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