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 |
|
|
47544 |
2h3c   |
cing | 2-parsed | STAR | dipolar coupling | 56 |
data_2h3c_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2h3c
_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_2h3c 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2h3c
_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 2h3c "Master copy" parsed_2h3c
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2h3c
_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 2h3c.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2h3c 1
1 2h3c.mr . . XPLOR/CNS 2 distance NOE simple 2310 parsed_2h3c 1
1 2h3c.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 275 parsed_2h3c 1
1 2h3c.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 56 parsed_2h3c 1
1 2h3c.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2h3c 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_4
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2h3c
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . -2.0 . . . . A 3 . N A 3 . HN parsed_2h3c 1
2 . . . . . . . . . . . . . . . . -2.0 . . . . B 103 . N B 103 . HN parsed_2h3c 1
3 . . . . . . . . . . . . . . . . -2.5 . . . . A 4 . N A 4 . HN parsed_2h3c 1
4 . . . . . . . . . . . . . . . . -2.5 . . . . B 104 . N B 104 . HN parsed_2h3c 1
5 . . . . . . . . . . . . . . . . -1.0 . . . . A 5 . N A 5 . HN parsed_2h3c 1
6 . . . . . . . . . . . . . . . . -1.0 . . . . B 105 . N B 105 . HN parsed_2h3c 1
7 . . . . . . . . . . . . . . . . -5.0 . . . . A 7 . N A 7 . HN parsed_2h3c 1
8 . . . . . . . . . . . . . . . . -5.0 . . . . B 107 . N B 107 . HN parsed_2h3c 1
9 . . . . . . . . . . . . . . . . -0.9 . . . . A 10 . N A 10 . HN parsed_2h3c 1
10 . . . . . . . . . . . . . . . . -0.9 . . . . B 110 . N B 110 . HN parsed_2h3c 1
11 . . . . . . . . . . . . . . . . 7.1 . . . . A 11 . N A 11 . HN parsed_2h3c 1
12 . . . . . . . . . . . . . . . . 7.1 . . . . B 111 . N B 111 . HN parsed_2h3c 1
13 . . . . . . . . . . . . . . . . -4.6 . . . . A 12 . N A 12 . HN parsed_2h3c 1
14 . . . . . . . . . . . . . . . . -4.6 . . . . B 112 . N B 112 . HN parsed_2h3c 1
15 . . . . . . . . . . . . . . . . 6.4 . . . . A 13 . N A 13 . HN parsed_2h3c 1
16 . . . . . . . . . . . . . . . . 6.4 . . . . B 113 . N B 113 . HN parsed_2h3c 1
17 . . . . . . . . . . . . . . . . 4.0 . . . . A 14 . N A 14 . HN parsed_2h3c 1
18 . . . . . . . . . . . . . . . . 4.0 . . . . B 114 . N B 114 . HN parsed_2h3c 1
19 . . . . . . . . . . . . . . . . 0.9 . . . . A 16 . N A 16 . HN parsed_2h3c 1
20 . . . . . . . . . . . . . . . . 0.9 . . . . B 116 . N B 116 . HN parsed_2h3c 1
21 . . . . . . . . . . . . . . . . 2.3 . . . . A 17 . N A 17 . HN parsed_2h3c 1
22 . . . . . . . . . . . . . . . . 2.3 . . . . B 117 . N B 117 . HN parsed_2h3c 1
23 . . . . . . . . . . . . . . . . 13.0 12.0 15.0 . . A 22 . N A 22 . HN parsed_2h3c 1
24 . . . . . . . . . . . . . . . . 13.0 12.0 15.0 . . B 122 . N B 122 . HN parsed_2h3c 1
25 . . . . . . . . . . . . . . . . 0.8 . . . . A 23 . N A 23 . HN parsed_2h3c 1
26 . . . . . . . . . . . . . . . . 0.8 . . . . B 123 . N B 123 . HN parsed_2h3c 1
27 . . . . . . . . . . . . . . . . -3.3 . . . . A 24 . N A 24 . HN parsed_2h3c 1
28 . . . . . . . . . . . . . . . . -3.3 . . . . B 124 . N B 124 . HN parsed_2h3c 1
29 . . . . . . . . . . . . . . . . -4.1 . . . . A 25 . N A 25 . HN parsed_2h3c 1
30 . . . . . . . . . . . . . . . . -4.1 . . . . B 125 . N B 125 . HN parsed_2h3c 1
31 . . . . . . . . . . . . . . . . -11.0 . . . . A 26 . N A 26 . HN parsed_2h3c 1
32 . . . . . . . . . . . . . . . . -11.0 . . . . B 126 . N B 126 . HN parsed_2h3c 1
33 . . . . . . . . . . . . . . . . -5.7 . . . . A 27 . N A 27 . HN parsed_2h3c 1
34 . . . . . . . . . . . . . . . . -5.7 . . . . B 127 . N B 127 . HN parsed_2h3c 1
35 . . . . . . . . . . . . . . . . -7.0 . . . . A 28 . N A 28 . HN parsed_2h3c 1
36 . . . . . . . . . . . . . . . . -7.0 . . . . B 128 . N B 128 . HN parsed_2h3c 1
37 . . . . . . . . . . . . . . . . -7.0 . . . . A 29 . N A 29 . HN parsed_2h3c 1
38 . . . . . . . . . . . . . . . . -7.0 . . . . B 129 . N B 129 . HN parsed_2h3c 1
39 . . . . . . . . . . . . . . . . -7.0 . . . . A 30 . N A 30 . HN parsed_2h3c 1
40 . . . . . . . . . . . . . . . . -7.0 . . . . B 130 . N B 130 . HN parsed_2h3c 1
41 . . . . . . . . . . . . . . . . -7.0 . . . . A 31 . N A 31 . HN parsed_2h3c 1
42 . . . . . . . . . . . . . . . . -7.0 . . . . B 131 . N B 131 . HN parsed_2h3c 1
43 . . . . . . . . . . . . . . . . -4.7 . . . . A 32 . N A 32 . HN parsed_2h3c 1
44 . . . . . . . . . . . . . . . . -4.7 . . . . B 132 . N B 132 . HN parsed_2h3c 1
45 . . . . . . . . . . . . . . . . -6.5 . . . . A 33 . N A 33 . HN parsed_2h3c 1
46 . . . . . . . . . . . . . . . . -6.5 . . . . B 133 . N B 133 . HN parsed_2h3c 1
47 . . . . . . . . . . . . . . . . -7.2 . . . . A 34 . N A 34 . HN parsed_2h3c 1
48 . . . . . . . . . . . . . . . . -7.2 . . . . B 134 . N B 134 . HN parsed_2h3c 1
49 . . . . . . . . . . . . . . . . -5.8 . . . . A 35 . N A 35 . HN parsed_2h3c 1
50 . . . . . . . . . . . . . . . . -5.8 . . . . B 135 . N B 135 . HN parsed_2h3c 1
51 . . . . . . . . . . . . . . . . -3.7 . . . . A 36 . N A 36 . HN parsed_2h3c 1
52 . . . . . . . . . . . . . . . . -3.7 . . . . B 136 . N B 136 . HN parsed_2h3c 1
53 . . . . . . . . . . . . . . . . -9.5 . . . . A 37 . N A 37 . HN parsed_2h3c 1
54 . . . . . . . . . . . . . . . . -9.5 . . . . B 137 . N B 137 . HN parsed_2h3c 1
55 . . . . . . . . . . . . . . . . -7.6 . . . . A 38 . N A 38 . HN parsed_2h3c 1
56 . . . . . . . . . . . . . . . . -7.6 . . . . B 138 . N B 138 . HN parsed_2h3c 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 "Dipolar Couplings" 2 1 2 20 parsed_2h3c 1
stop_
save_
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