Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
653663 | 7jsq RC | 30656 | cing | 2-parsed | STAR | dipolar coupling | 39 |
data_7jsq_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_7jsq
_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_7jsq 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_7jsq
_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 7jsq "Master copy" parsed_7jsq
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_7jsq
_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 7jsq.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_7jsq 1
1 7jsq.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 77 parsed_7jsq 1
1 7jsq.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 39 parsed_7jsq 1
1 7jsq.mr . . XPLOR/CNS 4 distance NOE simple 0 parsed_7jsq 1
1 7jsq.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_7jsq 1
1 7jsq.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_7jsq 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_3
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_7jsq
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 3
_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 . . . . . . . . . . . . . . . . 1.68793 . . . . . 137 . HA . 137 . CA parsed_7jsq 1
2 . . . . . . . . . . . . . . . . 0.611702 . . . . . 138 . HA . 138 . CA parsed_7jsq 1
3 . . . . . . . . . . . . . . . . 2.4928 . . . . . 139 . HA . 139 . CA parsed_7jsq 1
4 . . . . . . . . . . . . . . . . -2.2426 . . . . . 140 . HA . 140 . CA parsed_7jsq 1
5 . . . . . . . . . . . . . . . . -1.6286 . . . . . 140 . HB . 140 . CB parsed_7jsq 1
6 . . . . . . . . . . . . . . . . 0.322 . . . . . 141 . HA . 141 . CA parsed_7jsq 1
7 . . . . . . . . . . . . . . . . -0.813999 . . . . . 142 . HA . 142 . CA parsed_7jsq 1
8 . . . . . . . . . . . . . . . . -9.31464 . . . . . 142 . HB . 142 . CB parsed_7jsq 1
9 . . . . . . . . . . . . . . . . 1.29093 . . . . . 143 . HA . 143 . CA parsed_7jsq 1
10 . . . . . . . . . . . . . . . . 7.00247 . . . . . 144 . HA . 144 . CA parsed_7jsq 1
11 . . . . . . . . . . . . . . . . -2.53138 . . . . . 144 . HB . 144 . CB parsed_7jsq 1
12 . . . . . . . . . . . . . . . . 24.8339 . . . . . 146 . HA . 146 . CA parsed_7jsq 1
13 . . . . . . . . . . . . . . . . 14.012 . . . . . 151 . HA . 151 . CA parsed_7jsq 1
14 . . . . . . . . . . . . . . . . 11.1461 . . . . . 152 . HA . 152 . CA parsed_7jsq 1
15 . . . . . . . . . . . . . . . . 15.1591 . . . . . 152 . HB . 152 . CB parsed_7jsq 1
16 . . . . . . . . . . . . . . . . 16.2608 . . . . . 153 . HA . 153 . CA parsed_7jsq 1
17 . . . . . . . . . . . . . . . . 6.77547 . . . . . 153 . HB . 153 . CB parsed_7jsq 1
18 . . . . . . . . . . . . . . . . 7.86825 . . . . . 154 . HA . 154 . CA parsed_7jsq 1
19 . . . . . . . . . . . . . . . . 6.27991 . . . . . 154 . HB . 154 . CB parsed_7jsq 1
20 . . . . . . . . . . . . . . . . -0.427461 . . . . . 157 . HA . 157 . CA parsed_7jsq 1
21 . . . . . . . . . . . . . . . . -1.82779 . . . . . 158 . HA . 158 . CA parsed_7jsq 1
22 . . . . . . . . . . . . . . . . 15.2491 . . . . . 162 . HA . 162 . CA parsed_7jsq 1
23 . . . . . . . . . . . . . . . . 0.432332 . . . . . 163 . HA . 163 . CA parsed_7jsq 1
24 . . . . . . . . . . . . . . . . -3.74477 . . . . . 165 . HA . 165 . CA parsed_7jsq 1
25 . . . . . . . . . . . . . . . . 6.98692 . . . . . 166 . HA . 166 . CA parsed_7jsq 1
26 . . . . . . . . . . . . . . . . 3.36652 . . . . . 167 . HA . 167 . CA parsed_7jsq 1
27 . . . . . . . . . . . . . . . . 5.68833 . . . . . 168 . HA . 168 . CA parsed_7jsq 1
28 . . . . . . . . . . . . . . . . 4.11517 . . . . . 169 . HA . 169 . CA parsed_7jsq 1
29 . . . . . . . . . . . . . . . . -0.268888 . . . . . 170 . HA . 170 . CA parsed_7jsq 1
30 . . . . . . . . . . . . . . . . 15.3379 . . . . . 172 . HA . 172 . CA parsed_7jsq 1
31 . . . . . . . . . . . . . . . . 11.3136 . . . . . 173 . HA . 173 . CA parsed_7jsq 1
32 . . . . . . . . . . . . . . . . -2.27376 . . . . . 175 . HA . 175 . CA parsed_7jsq 1
33 . . . . . . . . . . . . . . . . -0.061927 . . . . . 176 . HA . 176 . CA parsed_7jsq 1
34 . . . . . . . . . . . . . . . . 0.724052 . . . . . 177 . HB . 177 . CB parsed_7jsq 1
35 . . . . . . . . . . . . . . . . -3.81318 . . . . . 178 . HA . 178 . CA parsed_7jsq 1
36 . . . . . . . . . . . . . . . . -3.56438 . . . . . 178 . HB . 178 . CB parsed_7jsq 1
37 . . . . . . . . . . . . . . . . -0.93923 . . . . . 182 . HA . 182 . CA parsed_7jsq 1
38 . . . . . . . . . . . . . . . . -3.7099 . . . . . 183 . HA . 183 . CA parsed_7jsq 1
39 . . . . . . . . . . . . . . . . 3.17026 . . . . . 184 . HA . 184 . CA parsed_7jsq 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
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 145 and name HA)
(resid 145 and name CA) 6.76648 0.670354
;
68 1 73 48 parsed_7jsq 1
2
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 155 and name HA)
(resid 155 and name CA) 7.22292 0.789943
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 156 and name HA)
(resid 156 and name CA) -0.682705 0.900272
;
122 1 133 50 parsed_7jsq 1
3
;
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 185 and name HA)
(resid 185 and name CA) 19.9339 0.671553
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 186 and name HA)
(resid 186 and name CA) 12.3923 0.716447
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 187 and name HA)
(resid 187 and name CA) 10.7202 0.602097
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 188 and name HA)
(resid 188 and name CA) 8.10981 0.47538
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 189 and name HA)
(resid 189 and name CA) 3.64177 0.584152
assign (resid 500 and name OO)
(resid 500 and name Z)
(resid 500 and name X)
(resid 500 and name Y)
(resid 190 and name HA)
(resid 190 and name CA) 4.72652 0.595881
;
255 1 290 48 parsed_7jsq 1
stop_
loop_
_RDC_constraint_parse_err.ID
_RDC_constraint_parse_err.Content
_RDC_constraint_parse_err.Begin_line
_RDC_constraint_parse_err.Begin_column
_RDC_constraint_parse_err.End_line
_RDC_constraint_parse_err.End_column
_RDC_constraint_parse_err.Entry_ID
_RDC_constraint_parse_err.RDC_constraint_list_ID
1 "# Restraints file 2: D_1000251321_mr_P3.xplor-nih.V1" 1 1 1 52 parsed_7jsq 1
stop_
save_