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 |
|
|
46645 |
2f3j   |
cing | 2-parsed | STAR | dipolar coupling | 61 |
data_2f3j_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2f3j
_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_2f3j 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2f3j
_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 2f3j "Master copy" parsed_2f3j
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2f3j
_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 2f3j.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2f3j 1
1 2f3j.mr . . unknown 2 sequence "Not applicable" "Not applicable" 0 parsed_2f3j 1
1 2f3j.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 142 parsed_2f3j 1
1 2f3j.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 80 parsed_2f3j 1
1 2f3j.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 61 parsed_2f3j 1
1 2f3j.mr . . XPLOR/CNS 6 distance NOE ambi 0 parsed_2f3j 1
1 2f3j.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2f3j 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2f3j
_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 . . . . . . . . . . . . . . . . -0.20 . . . . . 89 . N . 89 . HN parsed_2f3j 1
2 . . . . . . . . . . . . . . . . -6.10 . . . . . 90 . N . 90 . HN parsed_2f3j 1
3 . . . . . . . . . . . . . . . . 6.50 . . . . . 91 . N . 91 . HN parsed_2f3j 1
4 . . . . . . . . . . . . . . . . 5.80 . . . . . 92 . N . 92 . HN parsed_2f3j 1
5 . . . . . . . . . . . . . . . . 9.40 . . . . . 93 . N . 93 . HN parsed_2f3j 1
6 . . . . . . . . . . . . . . . . 8.30 . . . . . 94 . N . 94 . HN parsed_2f3j 1
7 . . . . . . . . . . . . . . . . -5.60 . . . . . 101 . N . 101 . HN parsed_2f3j 1
8 . . . . . . . . . . . . . . . . 6.20 . . . . . 102 . N . 102 . HN parsed_2f3j 1
9 . . . . . . . . . . . . . . . . 4.00 . . . . . 104 . N . 104 . HN parsed_2f3j 1
10 . . . . . . . . . . . . . . . . 2.90 . . . . . 105 . N . 105 . HN parsed_2f3j 1
11 . . . . . . . . . . . . . . . . 2.60 . . . . . 106 . N . 106 . HN parsed_2f3j 1
12 . . . . . . . . . . . . . . . . 0.00 . . . . . 107 . N . 107 . HN parsed_2f3j 1
13 . . . . . . . . . . . . . . . . 4.70 . . . . . 108 . N . 108 . HN parsed_2f3j 1
14 . . . . . . . . . . . . . . . . 1.50 . . . . . 109 . N . 109 . HN parsed_2f3j 1
15 . . . . . . . . . . . . . . . . -2.80 . . . . . 110 . N . 110 . HN parsed_2f3j 1
16 . . . . . . . . . . . . . . . . 2.60 . . . . . 111 . N . 111 . HN parsed_2f3j 1
17 . . . . . . . . . . . . . . . . 4.70 . . . . . 112 . N . 112 . HN parsed_2f3j 1
18 . . . . . . . . . . . . . . . . -9.20 . . . . . 113 . N . 113 . HN parsed_2f3j 1
19 . . . . . . . . . . . . . . . . 1.20 . . . . . 114 . N . 114 . HN parsed_2f3j 1
20 . . . . . . . . . . . . . . . . -6.70 . . . . . 115 . N . 115 . HN parsed_2f3j 1
21 . . . . . . . . . . . . . . . . 6.90 . . . . . 116 . N . 116 . HN parsed_2f3j 1
22 . . . . . . . . . . . . . . . . 5.10 . . . . . 117 . N . 117 . HN parsed_2f3j 1
23 . . . . . . . . . . . . . . . . 7.60 . . . . . 118 . N . 118 . HN parsed_2f3j 1
24 . . . . . . . . . . . . . . . . 1.90 . . . . . 120 . N . 120 . HN parsed_2f3j 1
25 . . . . . . . . . . . . . . . . 10.10 . . . . . 121 . N . 121 . HN parsed_2f3j 1
26 . . . . . . . . . . . . . . . . -0.90 . . . . . 122 . N . 122 . HN parsed_2f3j 1
27 . . . . . . . . . . . . . . . . -12.50 . . . . . 123 . N . 123 . HN parsed_2f3j 1
28 . . . . . . . . . . . . . . . . 0.10 . . . . . 124 . N . 124 . HN parsed_2f3j 1
29 . . . . . . . . . . . . . . . . 10.40 . . . . . 125 . N . 125 . HN parsed_2f3j 1
30 . . . . . . . . . . . . . . . . -13.70 . . . . . 126 . N . 126 . HN parsed_2f3j 1
31 . . . . . . . . . . . . . . . . -15.30 . . . . . 128 . N . 128 . HN parsed_2f3j 1
32 . . . . . . . . . . . . . . . . 6.50 . . . . . 129 . N . 129 . HN parsed_2f3j 1
33 . . . . . . . . . . . . . . . . 5.80 . . . . . 130 . N . 130 . HN parsed_2f3j 1
34 . . . . . . . . . . . . . . . . 5.80 . . . . . 131 . N . 131 . HN parsed_2f3j 1
35 . . . . . . . . . . . . . . . . 7.50 . . . . . 132 . N . 132 . HN parsed_2f3j 1
36 . . . . . . . . . . . . . . . . -1.30 . . . . . 135 . N . 135 . HN parsed_2f3j 1
37 . . . . . . . . . . . . . . . . 2.20 . . . . . 136 . N . 136 . HN parsed_2f3j 1
38 . . . . . . . . . . . . . . . . -15.60 . . . . . 138 . N . 138 . HN parsed_2f3j 1
39 . . . . . . . . . . . . . . . . -11.80 . . . . . 139 . N . 139 . HN parsed_2f3j 1
40 . . . . . . . . . . . . . . . . -3.50 . . . . . 140 . N . 140 . HN parsed_2f3j 1
41 . . . . . . . . . . . . . . . . 0.80 . . . . . 141 . N . 141 . HN parsed_2f3j 1
42 . . . . . . . . . . . . . . . . -9.90 . . . . . 142 . N . 142 . HN parsed_2f3j 1
43 . . . . . . . . . . . . . . . . -2.10 . . . . . 143 . N . 143 . HN parsed_2f3j 1
44 . . . . . . . . . . . . . . . . 2.90 . . . . . 144 . N . 144 . HN parsed_2f3j 1
45 . . . . . . . . . . . . . . . . -0.70 . . . . . 145 . N . 145 . HN parsed_2f3j 1
46 . . . . . . . . . . . . . . . . -8.80 . . . . . 146 . N . 146 . HN parsed_2f3j 1
47 . . . . . . . . . . . . . . . . 0.40 . . . . . 147 . N . 147 . HN parsed_2f3j 1
48 . . . . . . . . . . . . . . . . 3.70 . . . . . 148 . N . 148 . HN parsed_2f3j 1
49 . . . . . . . . . . . . . . . . 6.10 . . . . . 151 . N . 151 . HN parsed_2f3j 1
50 . . . . . . . . . . . . . . . . -0.70 . . . . . 154 . N . 154 . HN parsed_2f3j 1
51 . . . . . . . . . . . . . . . . 0.10 . . . . . 155 . N . 155 . HN parsed_2f3j 1
52 . . . . . . . . . . . . . . . . 5.40 . . . . . 156 . N . 156 . HN parsed_2f3j 1
53 . . . . . . . . . . . . . . . . 12.90 . . . . . 157 . N . 157 . HN parsed_2f3j 1
54 . . . . . . . . . . . . . . . . 1.20 . . . . . 159 . N . 159 . HN parsed_2f3j 1
55 . . . . . . . . . . . . . . . . 0.40 . . . . . 160 . N . 160 . HN parsed_2f3j 1
56 . . . . . . . . . . . . . . . . 8.70 . . . . . 161 . N . 161 . HN parsed_2f3j 1
57 . . . . . . . . . . . . . . . . 7.90 . . . . . 162 . N . 162 . HN parsed_2f3j 1
58 . . . . . . . . . . . . . . . . 10.00 . . . . . 163 . N . 163 . HN parsed_2f3j 1
59 . . . . . . . . . . . . . . . . 3.70 . . . . . 164 . N . 164 . HN parsed_2f3j 1
60 . . . . . . . . . . . . . . . . 7.60 . . . . . 165 . N . 165 . HN parsed_2f3j 1
61 . . . . . . . . . . . . . . . . 4.00 . . . . . 166 . N . 166 . HN parsed_2f3j 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 "Residual Dipolar Coupling restraints:" 2 1 2 40 parsed_2f3j 1
stop_
save_
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