NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
47971 |
2hqp   |
cing | 2-parsed | STAR | dipolar coupling | 51 |
data_2hqp_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2hqp
_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_2hqp 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2hqp
_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 2hqp "Master copy" parsed_2hqp
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2hqp
_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 2hqp.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2hqp 1
1 2hqp.mr . . XPLOR/CNS 2 distance NOE simple 1829 parsed_2hqp 1
1 2hqp.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 160 parsed_2hqp 1
1 2hqp.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 160 parsed_2hqp 1
1 2hqp.mr . . unknown 5 "chemical shift" "Not applicable" "Not applicable" 0 parsed_2hqp 1
1 2hqp.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 51 parsed_2hqp 1
1 2hqp.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2hqp 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_6
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2hqp
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 6
_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 . . . . . . . . . . . . . . . . -5.613 . . . . . 9 . N . 9 . HN parsed_2hqp 1
2 . . . . . . . . . . . . . . . . 7.015 . . . . . 11 . N . 11 . HN parsed_2hqp 1
3 . . . . . . . . . . . . . . . . -4.857 . . . . . 13 . N . 13 . HN parsed_2hqp 1
4 . . . . . . . . . . . . . . . . 10.48 . . . . . 15 . N . 15 . HN parsed_2hqp 1
5 . . . . . . . . . . . . . . . . -3.662 . . . . . 48 . N . 48 . HN parsed_2hqp 1
6 . . . . . . . . . . . . . . . . 10.749 . . . . . 51 . N . 51 . HN parsed_2hqp 1
7 . . . . . . . . . . . . . . . . -10.634 . . . . . 61 . N . 61 . HN parsed_2hqp 1
8 . . . . . . . . . . . . . . . . -8.41 . . . . . 63 . N . 63 . HN parsed_2hqp 1
9 . . . . . . . . . . . . . . . . -8.362 . . . . . 65 . N . 65 . HN parsed_2hqp 1
10 . . . . . . . . . . . . . . . . 7.837 . . . . . 66 . N . 66 . HN parsed_2hqp 1
11 . . . . . . . . . . . . . . . . 7.345 . . . . . 67 . N . 67 . HN parsed_2hqp 1
12 . . . . . . . . . . . . . . . . 4.601 . . . . . 68 . N . 68 . HN parsed_2hqp 1
13 . . . . . . . . . . . . . . . . -7.788 . . . . . 70 . N . 70 . HN parsed_2hqp 1
14 . . . . . . . . . . . . . . . . -2.86 . . . . . 73 . N . 73 . HN parsed_2hqp 1
15 . . . . . . . . . . . . . . . . -9.758 . . . . . 74 . N . 74 . HN parsed_2hqp 1
16 . . . . . . . . . . . . . . . . -8.244 . . . . . 75 . N . 75 . HN parsed_2hqp 1
17 . . . . . . . . . . . . . . . . 8.603 . . . . . 78 . N . 78 . HN parsed_2hqp 1
18 . . . . . . . . . . . . . . . . 13.506 . . . . . 80 . N . 80 . HN parsed_2hqp 1
19 . . . . . . . . . . . . . . . . 7.757 . . . . . 81 . N . 81 . HN parsed_2hqp 1
20 . . . . . . . . . . . . . . . . 5.564 . . . . . 82 . N . 82 . HN parsed_2hqp 1
21 . . . . . . . . . . . . . . . . 8.238 . . . . . 85 . N . 85 . HN parsed_2hqp 1
22 . . . . . . . . . . . . . . . . 9.2 . . . . . 86 . N . 86 . HN parsed_2hqp 1
23 . . . . . . . . . . . . . . . . 10.376 . . . . . 87 . N . 87 . HN parsed_2hqp 1
24 . . . . . . . . . . . . . . . . 8.746 . . . . . 88 . N . 88 . HN parsed_2hqp 1
25 . . . . . . . . . . . . . . . . -8.595 . . . . . 91 . N . 91 . HN parsed_2hqp 1
26 . . . . . . . . . . . . . . . . -2.294 . . . . . 106 . N . 106 . HN parsed_2hqp 1
27 . . . . . . . . . . . . . . . . -10.247 . . . . . 108 . N . 108 . HN parsed_2hqp 1
28 . . . . . . . . . . . . . . . . -5.186 . . . . . 113 . N . 113 . HN parsed_2hqp 1
29 . . . . . . . . . . . . . . . . -3.225 . . . . . 118 . N . 118 . HN parsed_2hqp 1
30 . . . . . . . . . . . . . . . . 5.104 . . . . . 123 . N . 123 . HN parsed_2hqp 1
31 . . . . . . . . . . . . . . . . 3.728 . . . . . 124 . N . 124 . HN parsed_2hqp 1
32 . . . . . . . . . . . . . . . . -10.563 . . . . . 131 . N . 131 . HN parsed_2hqp 1
33 . . . . . . . . . . . . . . . . -7.221 . . . . . 132 . N . 132 . HN parsed_2hqp 1
34 . . . . . . . . . . . . . . . . 1.56 . . . . . 133 . N . 133 . HN parsed_2hqp 1
35 . . . . . . . . . . . . . . . . 11.383 . . . . . 134 . N . 134 . HN parsed_2hqp 1
36 . . . . . . . . . . . . . . . . -0.931 . . . . . 135 . N . 135 . HN parsed_2hqp 1
37 . . . . . . . . . . . . . . . . 0.827 . . . . . 136 . N . 136 . HN parsed_2hqp 1
38 . . . . . . . . . . . . . . . . -6.578 . . . . . 137 . N . 137 . HN parsed_2hqp 1
39 . . . . . . . . . . . . . . . . -0.706 . . . . . 138 . N . 158 . HN parsed_2hqp 1
40 . . . . . . . . . . . . . . . . 5.373 . . . . . 140 . N . 140 . HN parsed_2hqp 1
41 . . . . . . . . . . . . . . . . 7.556 . . . . . 141 . N . 141 . HN parsed_2hqp 1
42 . . . . . . . . . . . . . . . . 5.88 . . . . . 144 . N . 144 . HN parsed_2hqp 1
43 . . . . . . . . . . . . . . . . 8.685 . . . . . 145 . N . 145 . HN parsed_2hqp 1
44 . . . . . . . . . . . . . . . . -1.098 . . . . . 147 . N . 147 . HN parsed_2hqp 1
45 . . . . . . . . . . . . . . . . -8.021 . . . . . 148 . N . 148 . HN parsed_2hqp 1
46 . . . . . . . . . . . . . . . . -0.76 . . . . . 150 . N . 150 . HN parsed_2hqp 1
47 . . . . . . . . . . . . . . . . -1.34 . . . . . 152 . N . 152 . HN parsed_2hqp 1
48 . . . . . . . . . . . . . . . . -3.227 . . . . . 158 . N . 158 . HN parsed_2hqp 1
49 . . . . . . . . . . . . . . . . -8.02 . . . . . 159 . N . 159 . HN parsed_2hqp 1
50 . . . . . . . . . . . . . . . . -6.926 . . . . . 160 . N . 160 . HN parsed_2hqp 1
51 . . . . . . . . . . . . . . . . 8.461 . . . . . 161 . N . 161 . HN parsed_2hqp 1
stop_
save_
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