NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
532160 |
2lbv   |
17577 | cing | 2-parsed | STAR | distance | general distance | ambi | 15 |
data_2lbv_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lbv
_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_2lbv 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lbv
_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 2lbv "Master copy" parsed_2lbv
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lbv
_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 2lbv.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lbv 1
1 2lbv.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 229 parsed_2lbv 1
1 2lbv.mr . . XPLOR/CNS 3 distance NOE simple 578 parsed_2lbv 1
1 2lbv.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 128 parsed_2lbv 1
1 2lbv.mr . . XPLOR/CNS 5 distance NOE simple 639 parsed_2lbv 1
1 2lbv.mr . . XPLOR/CNS 6 distance "general distance" simple 6 parsed_2lbv 1
1 2lbv.mr . . XPLOR/CNS 7 distance "general distance" ambi 15 parsed_2lbv 1
1 2lbv.mr . . XPLOR/CNS 8 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2lbv 1
1 2lbv.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lbv 1
stop_
save_
save_CNS/XPLOR_distance_constraints_7
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2lbv
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 7
_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_2lbv 1
2 1 . . . parsed_2lbv 1
3 1 . . . parsed_2lbv 1
4 1 . . . parsed_2lbv 1
5 1 . . . parsed_2lbv 1
6 1 . . . parsed_2lbv 1
7 1 . . . parsed_2lbv 1
8 1 . . . parsed_2lbv 1
9 1 . . . parsed_2lbv 1
10 1 . . . parsed_2lbv 1
11 1 . . . parsed_2lbv 1
12 1 . . . parsed_2lbv 1
13 1 . . . parsed_2lbv 1
14 1 . . . parsed_2lbv 1
15 1 . . . parsed_2lbv 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 . . . . . . . . . 9 . HD1* parsed_2lbv 1
1 1 2 . . . . . . . . . 300 . HAA parsed_2lbv 1
1 1 2 . . . . . . . . . 300 . HAB parsed_2lbv 1
1 1 2 . . . . . . . . . 300 . HAC parsed_2lbv 1
2 1 1 . . . . . . . . . 13 . HD1 parsed_2lbv 1
2 1 2 . . . . . . . . . 300 . HAA parsed_2lbv 1
2 1 2 . . . . . . . . . 300 . HAB parsed_2lbv 1
2 1 2 . . . . . . . . . 300 . HAC parsed_2lbv 1
3 1 1 . . . . . . . . . 13 . HE1 parsed_2lbv 1
3 1 2 . . . . . . . . . 300 . HAA parsed_2lbv 1
3 1 2 . . . . . . . . . 300 . HAB parsed_2lbv 1
3 1 2 . . . . . . . . . 300 . HAC parsed_2lbv 1
4 1 1 . . . . . . . . . 15 . HG2* parsed_2lbv 1
4 1 2 . . . . . . . . . 300 . HAL parsed_2lbv 1
4 1 2 . . . . . . . . . 300 . HAM parsed_2lbv 1
4 1 2 . . . . . . . . . 300 . HAP parsed_2lbv 1
4 1 2 . . . . . . . . . 300 . HAQ parsed_2lbv 1
4 1 2 . . . . . . . . . 300 . HAT parsed_2lbv 1
4 1 2 . . . . . . . . . 300 . HAU parsed_2lbv 1
4 1 2 . . . . . . . . . 300 . HAX parsed_2lbv 1
4 1 2 . . . . . . . . . 300 . HAY parsed_2lbv 1
5 1 1 . . . . . . . . . 39 . HD1* parsed_2lbv 1
5 1 2 . . . . . . . . . 300 . HAA parsed_2lbv 1
5 1 2 . . . . . . . . . 300 . HAB parsed_2lbv 1
5 1 2 . . . . . . . . . 300 . HAC parsed_2lbv 1
6 1 1 . . . . . . . . . 39 . HD1* parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HA1 parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HA2 parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HA3 parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HA4 parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAD parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAE parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAF parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAG parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAH parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAI parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAJ parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAK parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAN parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAO parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAQ parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAR parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAS parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAV parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAW parsed_2lbv 1
6 1 2 . . . . . . . . . 300 . HAZ parsed_2lbv 1
7 1 1 . . . . . . . . . 39 . HG2* parsed_2lbv 1
7 1 2 . . . . . . . . . 300 . HAA parsed_2lbv 1
7 1 2 . . . . . . . . . 300 . HAB parsed_2lbv 1
7 1 2 . . . . . . . . . 300 . HAC parsed_2lbv 1
8 1 1 . . . . . . . . . 49 . HG2* parsed_2lbv 1
8 1 2 . . . . . . . . . 300 . HAA parsed_2lbv 1
8 1 2 . . . . . . . . . 300 . HAB parsed_2lbv 1
8 1 2 . . . . . . . . . 300 . HAC parsed_2lbv 1
9 1 1 . . . . . . . . . 49 . HG2* parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HA1 parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HA2 parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HA3 parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HA4 parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAD parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAE parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAF parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAG parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAH parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAI parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAJ parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAK parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAN parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAO parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAQ parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAR parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAS parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAV parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAW parsed_2lbv 1
9 1 2 . . . . . . . . . 300 . HAZ parsed_2lbv 1
10 1 1 . . . . . . . . . 49 . HG1* parsed_2lbv 1
10 1 2 . . . . . . . . . 300 . HAA parsed_2lbv 1
10 1 2 . . . . . . . . . 300 . HAB parsed_2lbv 1
10 1 2 . . . . . . . . . 300 . HAC parsed_2lbv 1
11 1 1 . . . . . . . . . 49 . HG1* parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HA1 parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HA2 parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HA3 parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HA4 parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAD parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAE parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAF parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAG parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAH parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAI parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAJ parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAK parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAN parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAO parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAQ parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAR parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAS parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAV parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAW parsed_2lbv 1
11 1 2 . . . . . . . . . 300 . HAZ parsed_2lbv 1
12 1 1 . . . . . . . . . 85 . HG2* parsed_2lbv 1
12 1 2 . . . . . . . . . 300 . HAA parsed_2lbv 1
12 1 2 . . . . . . . . . 300 . HAB parsed_2lbv 1
12 1 2 . . . . . . . . . 300 . HAC parsed_2lbv 1
13 1 1 . . . . . . . . . 85 . HG2* parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HA1 parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HA2 parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HA3 parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HA4 parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAD parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAE parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAF parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAG parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAH parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAI parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAJ parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAK parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAN parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAO parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAQ parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAR parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAS parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAV parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAW parsed_2lbv 1
13 1 2 . . . . . . . . . 300 . HAZ parsed_2lbv 1
14 1 1 . . . . . . . . . 98 . HD1* parsed_2lbv 1
14 1 2 . . . . . . . . . 300 . HAA parsed_2lbv 1
14 1 2 . . . . . . . . . 300 . HAB parsed_2lbv 1
14 1 2 . . . . . . . . . 300 . HAC parsed_2lbv 1
15 1 1 . . . . . . . . . 98 . HD1* parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HA1 parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HA2 parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HA3 parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HA4 parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAD parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAE parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAF parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAG parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAH parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAI parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAJ parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAK parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAN parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAO parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAQ parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAR parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAS parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAV parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAW parsed_2lbv 1
15 1 2 . . . . . . . . . 300 . HAZ parsed_2lbv 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 . . . . . 5.5 0.5 5.5 parsed_2lbv 1
2 1 . . . . . 5.5 0.5 5.5 parsed_2lbv 1
3 1 . . . . . 5.5 0.5 5.5 parsed_2lbv 1
4 1 . . . . . 5.5 0.5 5.5 parsed_2lbv 1
5 1 . . . . . 5.5 0.5 5.5 parsed_2lbv 1
6 1 . . . . . 4.0 0.0 4.0 parsed_2lbv 1
7 1 . . . . . 4.0 0.5 4.0 parsed_2lbv 1
8 1 . . . . . 3.5 0.5 3.5 parsed_2lbv 1
9 1 . . . . . 4.0 0.0 4.0 parsed_2lbv 1
10 1 . . . . . 5.5 0.5 5.5 parsed_2lbv 1
11 1 . . . . . 4.5 0.5 4.5 parsed_2lbv 1
12 1 . . . . . 6.0 0.5 6.0 parsed_2lbv 1
13 1 . . . . . 4.5 0.5 4.5 parsed_2lbv 1
14 1 . . . . . 5.5 0.5 5.5 parsed_2lbv 1
15 1 . . . . . 4.0 0.0 4.0 parsed_2lbv 1
stop_
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1
;
assign ( resid 92 and name OH)
(
( resid 300 and name OAU)
or
( resid 300 and name HAV)
4.0 3.5 0.0
;
1 1 6 20 parsed_2lbv 1
2
;
assign ( resid 90 and name OG1)
(
( resid 300 and name OAU)
or
( resid 300 and name HAV)
4.0 3.5 0.0
;
7 1 12 20 parsed_2lbv 1
stop_
save_
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