NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
634297 |
6gvt   |
34290 | cing | 2-parsed | STAR | distance | general distance | simple | 54 |
data_6gvt_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6gvt
_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_6gvt 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6gvt
_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 6gvt "Master copy" parsed_6gvt
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6gvt
_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 6gvt.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6gvt 1
1 6gvt.mr . . DYANA/DIANA 2 "dihedral angle" "Not applicable" "Not applicable" 177 parsed_6gvt 1
1 6gvt.mr . . DYANA/DIANA 3 distance "hydrogen bond" simple 232 parsed_6gvt 1
1 6gvt.mr . . DYANA/DIANA 4 distance NOE simple 118 parsed_6gvt 1
1 6gvt.mr . . DYANA/DIANA 5 distance NOE simple 2271 parsed_6gvt 1
1 6gvt.mr . . DYANA/DIANA 6 distance "general distance" simple 54 parsed_6gvt 1
1 6gvt.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6gvt 1
stop_
save_
save_DYANA/DIANA_distance_constraints_6
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6gvt
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 6
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_6gvt 1
2 1 . . . parsed_6gvt 1
3 1 . . . parsed_6gvt 1
4 1 . . . parsed_6gvt 1
5 1 . . . parsed_6gvt 1
6 1 . . . parsed_6gvt 1
7 1 . . . parsed_6gvt 1
8 1 . . . parsed_6gvt 1
9 1 . . . parsed_6gvt 1
10 1 . . . parsed_6gvt 1
11 1 . . . parsed_6gvt 1
12 1 . . . parsed_6gvt 1
13 1 . . . parsed_6gvt 1
14 1 . . . parsed_6gvt 1
15 1 . . . parsed_6gvt 1
16 1 . . . parsed_6gvt 1
17 1 . . . parsed_6gvt 1
18 1 . . . parsed_6gvt 1
19 1 . . . parsed_6gvt 1
20 1 . . . parsed_6gvt 1
21 1 . . . parsed_6gvt 1
22 1 . . . parsed_6gvt 1
23 1 . . . parsed_6gvt 1
24 1 . . . parsed_6gvt 1
25 1 . . . parsed_6gvt 1
26 1 . . . parsed_6gvt 1
27 1 . . . parsed_6gvt 1
28 1 . . . parsed_6gvt 1
29 1 . . . parsed_6gvt 1
30 1 . . . parsed_6gvt 1
31 1 . . . parsed_6gvt 1
32 1 . . . parsed_6gvt 1
33 1 . . . parsed_6gvt 1
34 1 . . . parsed_6gvt 1
35 1 . . . parsed_6gvt 1
36 1 . . . parsed_6gvt 1
37 1 . . . parsed_6gvt 1
38 1 . . . parsed_6gvt 1
39 1 . . . parsed_6gvt 1
40 1 . . . parsed_6gvt 1
41 1 . . . parsed_6gvt 1
42 1 . . . parsed_6gvt 1
43 1 . . . parsed_6gvt 1
44 1 . . . parsed_6gvt 1
45 1 . . . parsed_6gvt 1
46 1 . . . parsed_6gvt 1
47 1 . . . parsed_6gvt 1
48 1 . . . parsed_6gvt 1
49 1 . . . parsed_6gvt 1
50 1 . . . parsed_6gvt 1
51 1 . . . parsed_6gvt 1
52 1 . . . parsed_6gvt 1
53 1 . . . parsed_6gvt 1
54 1 . . . parsed_6gvt 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . . 400 ATP PG parsed_6gvt 1
1 1 2 . . . . . . . . . 400 ATP PA parsed_6gvt 1
2 1 1 . . . . . . . . . 400 ATP PG parsed_6gvt 1
2 1 2 . . . . . . . . . 400 ATP O3A parsed_6gvt 1
3 1 1 . . . . . . . . . 400 ATP PG parsed_6gvt 1
3 1 2 . . . . . . . . . 400 ATP O2A parsed_6gvt 1
4 1 1 . . . . . . . . . 410 ATP PG parsed_6gvt 1
4 1 2 . . . . . . . . . 410 ATP PA parsed_6gvt 1
5 1 1 . . . . . . . . . 410 ATP O1B parsed_6gvt 1
5 1 2 . . . . . . . . . 410 ATP PG parsed_6gvt 1
6 1 1 . . . . . . . . . 410 ATP O1B parsed_6gvt 1
6 1 2 . . . . . . . . . 410 ATP PA parsed_6gvt 1
7 1 1 . . . . . . . . . 410 ATP O1A parsed_6gvt 1
7 1 2 . . . . . . . . . 410 ATP O3G parsed_6gvt 1
8 1 1 . . . . . . . . . 410 ATP O1A parsed_6gvt 1
8 1 2 . . . . . . . . . 410 ATP O2G parsed_6gvt 1
9 1 1 . . . . . . . . . 410 ATP O1A parsed_6gvt 1
9 1 2 . . . . . . . . . 410 ATP PG parsed_6gvt 1
10 1 1 . . . . . . . . . 305 VAL H parsed_6gvt 1
10 1 2 . . . . . . . . . 308 ASP MG parsed_6gvt 1
11 1 1 . . . . . . . . . 306 ASN QD2 parsed_6gvt 1
11 1 2 . . . . . . . . . 308 ASP MG parsed_6gvt 1
12 1 1 . . . . . . . . . 308 ASP H parsed_6gvt 1
12 1 2 . . . . . . . . . 308 ASP MG parsed_6gvt 1
13 1 1 . . . . . . . . . 309 ARG HE parsed_6gvt 1
13 1 2 . . . . . . . . . 308 ASP MG parsed_6gvt 1
14 1 1 . . . . . . . . . 311 ARG HE parsed_6gvt 1
14 1 2 . . . . . . . . . 308 ASP MG parsed_6gvt 1
15 1 1 . . . . . . . . . 344 ASN QD2 parsed_6gvt 1
15 1 2 . . . . . . . . . 343 GLU MG parsed_6gvt 1
16 1 1 . . . . . . . . . 346 LYS H parsed_6gvt 1
16 1 2 . . . . . . . . . 343 GLU MG parsed_6gvt 1
17 1 1 . . . . . . . . . 347 TRP HE1 parsed_6gvt 1
17 1 2 . . . . . . . . . 343 GLU MG parsed_6gvt 1
18 1 1 . . . . . . . . . 348 ASN QD2 parsed_6gvt 1
18 1 2 . . . . . . . . . 343 GLU MG parsed_6gvt 1
19 1 1 . . . . . . . . . 345 GLU H parsed_6gvt 1
19 1 2 . . . . . . . . . 343 GLU MG parsed_6gvt 1
20 1 1 . . . . . . . . . 322 LYS O parsed_6gvt 1
20 1 2 . . . . . . . . . 367 TYR HH parsed_6gvt 1
21 1 1 . . . . . . . . . 322 LYS NZ parsed_6gvt 1
21 1 2 . . . . . . . . . 7 DT O4 parsed_6gvt 1
22 1 1 . . . . . . . . . 400 ATP PG parsed_6gvt 1
22 1 2 . . . . . . . . . 309 ARG NE parsed_6gvt 1
23 1 1 . . . . . . . . . 400 ATP PG parsed_6gvt 1
23 1 2 . . . . . . . . . 309 ARG CZ parsed_6gvt 1
24 1 1 . . . . . . . . . 410 ATP PB parsed_6gvt 1
24 1 2 . . . . . . . . . 309 ARG NH1 parsed_6gvt 1
25 1 1 . . . . . . . . . 410 ATP PB parsed_6gvt 1
25 1 2 . . . . . . . . . 309 ARG NH2 parsed_6gvt 1
26 1 1 . . . . . . . . . 341 ALA CA parsed_6gvt 1
26 1 2 . . . . . . . . . 410 ATP PG parsed_6gvt 1
27 1 1 . . . . . . . . . 341 ALA CB parsed_6gvt 1
27 1 2 . . . . . . . . . 410 ATP PG parsed_6gvt 1
28 1 1 . . . . . . . . . 400 ATP PG parsed_6gvt 1
28 1 2 . . . . . . . . . 400 ATP PA parsed_6gvt 1
29 1 1 . . . . . . . . . 400 ATP PG parsed_6gvt 1
29 1 2 . . . . . . . . . 400 ATP O3A parsed_6gvt 1
30 1 1 . . . . . . . . . 400 ATP PG parsed_6gvt 1
30 1 2 . . . . . . . . . 400 ATP O2A parsed_6gvt 1
31 1 1 . . . . . . . . . 410 ATP PG parsed_6gvt 1
31 1 2 . . . . . . . . . 410 ATP PA parsed_6gvt 1
32 1 1 . . . . . . . . . 410 ATP O1B parsed_6gvt 1
32 1 2 . . . . . . . . . 410 ATP PG parsed_6gvt 1
33 1 1 . . . . . . . . . 410 ATP O1B parsed_6gvt 1
33 1 2 . . . . . . . . . 410 ATP PA parsed_6gvt 1
34 1 1 . . . . . . . . . 410 ATP O1A parsed_6gvt 1
34 1 2 . . . . . . . . . 410 ATP O3G parsed_6gvt 1
35 1 1 . . . . . . . . . 410 ATP O1A parsed_6gvt 1
35 1 2 . . . . . . . . . 410 ATP O2G parsed_6gvt 1
36 1 1 . . . . . . . . . 410 ATP O1A parsed_6gvt 1
36 1 2 . . . . . . . . . 410 ATP PG parsed_6gvt 1
37 1 1 . . . . . . . . . 305 VAL H parsed_6gvt 1
37 1 2 . . . . . . . . . 308 ASP MG parsed_6gvt 1
38 1 1 . . . . . . . . . 306 ASN QD2 parsed_6gvt 1
38 1 2 . . . . . . . . . 308 ASP MG parsed_6gvt 1
39 1 1 . . . . . . . . . 308 ASP H parsed_6gvt 1
39 1 2 . . . . . . . . . 308 ASP MG parsed_6gvt 1
40 1 1 . . . . . . . . . 309 ARG HE parsed_6gvt 1
40 1 2 . . . . . . . . . 308 ASP MG parsed_6gvt 1
41 1 1 . . . . . . . . . 311 ARG HE parsed_6gvt 1
41 1 2 . . . . . . . . . 308 ASP MG parsed_6gvt 1
42 1 1 . . . . . . . . . 344 ASN QD2 parsed_6gvt 1
42 1 2 . . . . . . . . . 343 GLU MG parsed_6gvt 1
43 1 1 . . . . . . . . . 346 LYS H parsed_6gvt 1
43 1 2 . . . . . . . . . 343 GLU MG parsed_6gvt 1
44 1 1 . . . . . . . . . 347 TRP HE1 parsed_6gvt 1
44 1 2 . . . . . . . . . 343 GLU MG parsed_6gvt 1
45 1 1 . . . . . . . . . 348 ASN QD2 parsed_6gvt 1
45 1 2 . . . . . . . . . 343 GLU MG parsed_6gvt 1
46 1 1 . . . . . . . . . 345 GLU H parsed_6gvt 1
46 1 2 . . . . . . . . . 343 GLU MG parsed_6gvt 1
47 1 1 . . . . . . . . . 322 LYS O parsed_6gvt 1
47 1 2 . . . . . . . . . 367 TYR HH parsed_6gvt 1
48 1 1 . . . . . . . . . 322 LYS NZ parsed_6gvt 1
48 1 2 . . . . . . . . . 7 DT O4 parsed_6gvt 1
49 1 1 . . . . . . . . . 400 ATP PG parsed_6gvt 1
49 1 2 . . . . . . . . . 309 ARG NE parsed_6gvt 1
50 1 1 . . . . . . . . . 400 ATP PG parsed_6gvt 1
50 1 2 . . . . . . . . . 309 ARG CZ parsed_6gvt 1
51 1 1 . . . . . . . . . 410 ATP PB parsed_6gvt 1
51 1 2 . . . . . . . . . 309 ARG NH1 parsed_6gvt 1
52 1 1 . . . . . . . . . 410 ATP PB parsed_6gvt 1
52 1 2 . . . . . . . . . 309 ARG NH2 parsed_6gvt 1
53 1 1 . . . . . . . . . 341 ALA CA parsed_6gvt 1
53 1 2 . . . . . . . . . 410 ATP PG parsed_6gvt 1
54 1 1 . . . . . . . . . 341 ALA CB parsed_6gvt 1
54 1 2 . . . . . . . . . 410 ATP PG parsed_6gvt 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . . . 4.3 parsed_6gvt 1
2 1 . . . . . . . 2.9 parsed_6gvt 1
3 1 . . . . . . . 4.0 parsed_6gvt 1
4 1 . . . . . . . 3.9 parsed_6gvt 1
5 1 . . . . . . . 2.7 parsed_6gvt 1
6 1 . . . . . . . 2.7 parsed_6gvt 1
7 1 . . . . . . . 2.9 parsed_6gvt 1
8 1 . . . . . . . 3.9 parsed_6gvt 1
9 1 . . . . . . . 3.8 parsed_6gvt 1
10 1 . . . . . . . 3.4 parsed_6gvt 1
11 1 . . . . . . . 3.4 parsed_6gvt 1
12 1 . . . . . . . 1.8 parsed_6gvt 1
13 1 . . . . . . . 1.8 parsed_6gvt 1
14 1 . . . . . . . 1.8 parsed_6gvt 1
15 1 . . . . . . . 1.8 parsed_6gvt 1
16 1 . . . . . . . 1.8 parsed_6gvt 1
17 1 . . . . . . . 1.8 parsed_6gvt 1
18 1 . . . . . . . 1.8 parsed_6gvt 1
19 1 . . . . . . . 1.8 parsed_6gvt 1
20 1 . . . . . . . 5.5 parsed_6gvt 1
21 1 . . . . . . . 3.0 parsed_6gvt 1
22 1 . . . . . . . 3.5 parsed_6gvt 1
23 1 . . . . . . . 3.5 parsed_6gvt 1
24 1 . . . . . . . 3.5 parsed_6gvt 1
25 1 . . . . . . . 3.5 parsed_6gvt 1
26 1 . . . . . . . 3.5 parsed_6gvt 1
27 1 . . . . . . . 3.5 parsed_6gvt 1
28 1 . . . . . . . 4.5 parsed_6gvt 1
29 1 . . . . . . . 3.5 parsed_6gvt 1
30 1 . . . . . . . 4.7 parsed_6gvt 1
31 1 . . . . . . . 4.3 parsed_6gvt 1
32 1 . . . . . . . 3.1 parsed_6gvt 1
33 1 . . . . . . . 3.1 parsed_6gvt 1
34 1 . . . . . . . 3.1 parsed_6gvt 1
35 1 . . . . . . . 4.6 parsed_6gvt 1
36 1 . . . . . . . 4.1 parsed_6gvt 1
37 1 . . . . . . . 10.0 parsed_6gvt 1
38 1 . . . . . . . 10.0 parsed_6gvt 1
39 1 . . . . . . . 10.0 parsed_6gvt 1
40 1 . . . . . . . 10.0 parsed_6gvt 1
41 1 . . . . . . . 10.0 parsed_6gvt 1
42 1 . . . . . . . 10.0 parsed_6gvt 1
43 1 . . . . . . . 10.0 parsed_6gvt 1
44 1 . . . . . . . 10.0 parsed_6gvt 1
45 1 . . . . . . . 10.0 parsed_6gvt 1
46 1 . . . . . . . 10.0 parsed_6gvt 1
47 1 . . . . . . . 50.0 parsed_6gvt 1
48 1 . . . . . . . 50.0 parsed_6gvt 1
49 1 . . . . . . . 8.0 parsed_6gvt 1
50 1 . . . . . . . 8.0 parsed_6gvt 1
51 1 . . . . . . . 7.0 parsed_6gvt 1
52 1 . . . . . . . 7.0 parsed_6gvt 1
53 1 . . . . . . . 7.0 parsed_6gvt 1
54 1 . . . . . . . 8.0 parsed_6gvt 1
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1 "Restraints file 5: hybrid-structure-longrangebondtype-restraints-cyana.rstr" 1 1 1 77 parsed_6gvt 1
2 "Long-range bond-type restraints" 2 1 2 32 parsed_6gvt 1
3 "lower limits" 4 1 4 13 parsed_6gvt 1
4 "#########################################" 6 1 6 43 parsed_6gvt 1
5 ATP1-intramolecular####################### 7 1 7 43 parsed_6gvt 1
6 "#########################################" 15 1 15 43 parsed_6gvt 1
7 "#########################################" 18 1 18 43 parsed_6gvt 1
8 ATP2-intramolecular####################### 19 1 19 43 parsed_6gvt 1
9 "########################################" 31 1 31 42 parsed_6gvt 1
10 "#########################################" 35 1 35 43 parsed_6gvt 1
11 "Paramagnetic DATA#########################" 36 1 36 43 parsed_6gvt 1
12 "#########################################" 59 1 59 43 parsed_6gvt 1
13 "#########################################" 62 1 62 43 parsed_6gvt 1
14 "REPULSIVE RESTRAINTS######################" 63 1 63 43 parsed_6gvt 1
15 "#########################################" 69 1 69 43 parsed_6gvt 1
16 "#########################################" 72 1 72 43 parsed_6gvt 1
17 "solid-state NMR###########################" 73 1 73 43 parsed_6gvt 1
18 "#########################################" 87 1 87 43 parsed_6gvt 1
19 "upper limits" 90 1 90 13 parsed_6gvt 1
20 "#########################################" 93 1 93 43 parsed_6gvt 1
21 ATP1-intramolecular####################### 94 1 94 43 parsed_6gvt 1
22 "#########################################" 102 1 102 43 parsed_6gvt 1
23 "#########################################" 105 1 105 43 parsed_6gvt 1
24 ATP2-intramolecular####################### 106 1 106 43 parsed_6gvt 1
25 "########################################" 118 1 118 42 parsed_6gvt 1
26 "#########################################" 121 1 121 43 parsed_6gvt 1
27 "Paramagnetic DATA#########################" 122 1 122 43 parsed_6gvt 1
28 "#########################################" 145 1 145 43 parsed_6gvt 1
29 "#########################################" 148 1 148 43 parsed_6gvt 1
30 "REPULSIVE RESTRAINTS######################" 149 1 149 43 parsed_6gvt 1
31 "#########################################" 155 1 155 43 parsed_6gvt 1
32 "#########################################" 158 1 158 43 parsed_6gvt 1
33 "solid-state NMR" 159 1 159 16 parsed_6gvt 1
stop_
save_
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