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 | subtype | subsubtype | item_count |
|
|
37903 |
1qg1   |
cing | 2-parsed | STAR | distance | NOE | ambi | 21 |
data_1qg1_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1qg1
_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_1qg1 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1qg1
_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 1qg1 "Master copy" parsed_1qg1
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1qg1
_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 1qg1.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1qg1 1
1 1qg1.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1qg1 1
1 1qg1.mr . . XPLOR/CNS 3 distance NOE simple 1059 parsed_1qg1 1
1 1qg1.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1qg1 1
1 1qg1.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 36 parsed_1qg1 1
1 1qg1.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_1qg1 1
1 1qg1.mr . . XPLOR/CNS 7 distance NOE ambi 122 parsed_1qg1 1
1 1qg1.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_1qg1 1
1 1qg1.mr . . XPLOR/CNS 9 distance NOE ambi 323 parsed_1qg1 1
1 1qg1.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_1qg1 1
1 1qg1.mr . . XPLOR/CNS 11 distance NOE ambi 67 parsed_1qg1 1
1 1qg1.mr . . n/a 12 comment "Not applicable" "Not applicable" 0 parsed_1qg1 1
1 1qg1.mr . . XPLOR/CNS 13 distance NOE ambi 21 parsed_1qg1 1
1 1qg1.mr . . n/a 14 comment "Not applicable" "Not applicable" 0 parsed_1qg1 1
1 1qg1.mr . . XPLOR/CNS 15 distance "hydrogen bond" simple 0 parsed_1qg1 1
1 1qg1.mr . . "MR format" 16 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1qg1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_13
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1qg1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 13
_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_1qg1 1
2 1 . . . parsed_1qg1 1
3 1 . . . parsed_1qg1 1
4 1 . . . parsed_1qg1 1
5 1 . . . parsed_1qg1 1
6 1 . . . parsed_1qg1 1
7 1 . . . parsed_1qg1 1
8 1 . . . parsed_1qg1 1
9 1 . . . parsed_1qg1 1
10 1 . . . parsed_1qg1 1
11 1 . . . parsed_1qg1 1
12 1 . . . parsed_1qg1 1
13 1 . . . parsed_1qg1 1
14 1 . . . parsed_1qg1 1
15 1 . . . parsed_1qg1 1
16 1 . . . parsed_1qg1 1
17 1 . . . parsed_1qg1 1
18 1 . . . parsed_1qg1 1
19 1 . . . parsed_1qg1 1
20 1 . . . parsed_1qg1 1
21 1 . . . parsed_1qg1 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 . . . . . . . . 2GSH 12 . HD# parsed_1qg1 1
1 1 1 . . . . . . . . 2GSH 39 . HB# parsed_1qg1 1
1 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
1 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
2 1 1 . . . . . . . . 2GSH 53 . HB# parsed_1qg1 1
2 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
2 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
3 1 1 . . . . . . . . 2GSH 12 . HD# parsed_1qg1 1
3 1 1 . . . . . . . . 2GSH 39 . HB# parsed_1qg1 1
3 1 2 . . . . . . . . 1SHC 8 . HG* parsed_1qg1 1
4 1 1 . . . . . . . . 2GSH 53 . HB# parsed_1qg1 1
4 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
4 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
5 1 1 . . . . . . . . 2GSH 54 . HE# parsed_1qg1 1
5 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
5 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
6 1 1 . . . . . . . . 2GSH 54 . HE# parsed_1qg1 1
6 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
6 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
7 1 1 . . . . . . . . 2GSH 12 . HB# parsed_1qg1 1
7 1 2 . . . . . . . . 1SHC 2 . HB# parsed_1qg1 1
7 1 2 . . . . . . . . 1SHC 3 . HG# parsed_1qg1 1
8 1 1 . . . . . . . . 2GSH 54 . HB# parsed_1qg1 1
8 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
8 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
9 1 1 . . . . . . . . 2GSH 54 . HB# parsed_1qg1 1
9 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
9 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
10 1 1 . . . . . . . . 2GSH 12 . HB# parsed_1qg1 1
10 1 2 . . . . . . . . 1SHC 2 . HB# parsed_1qg1 1
10 1 2 . . . . . . . . 1SHC 3 . HG# parsed_1qg1 1
11 1 1 . . . . . . . . 2GSH 12 . HB# parsed_1qg1 1
11 1 2 . . . . . . . . 1SHC 2 . HB# parsed_1qg1 1
11 1 2 . . . . . . . . 1SHC 3 . HG# parsed_1qg1 1
12 1 1 . . . . . . . . 2GSH 54 . HD# parsed_1qg1 1
12 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
12 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
13 1 1 . . . . . . . . 2GSH 54 . HD# parsed_1qg1 1
13 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
13 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
14 1 1 . . . . . . . . 2GSH 52 . HE1 parsed_1qg1 1
14 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
14 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
15 1 1 . . . . . . . . 2GSH 54 . HG# parsed_1qg1 1
15 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
15 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
16 1 1 . . . . . . . . 2GSH 86 . HB# parsed_1qg1 1
16 1 2 . . . . . . . . 1SHC 6 . HG* parsed_1qg1 1
17 1 1 . . . . . . . . 2GSH 33 . HB# parsed_1qg1 1
17 1 1 . . . . . . . . 2GSH 35 . HB# parsed_1qg1 1
17 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
17 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
18 1 1 . . . . . . . . 2GSH 43 . HA parsed_1qg1 1
18 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
18 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
19 1 1 . . . . . . . . 2GSH 40 . HA parsed_1qg1 1
19 1 1 . . . . . . . . 2GSH 41 . HA parsed_1qg1 1
19 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
19 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
20 1 1 . . . . . . . . 2GSH 52 . HA parsed_1qg1 1
20 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
20 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 1
21 1 1 . . . . . . . . 2GSH 54 . HA parsed_1qg1 1
21 1 2 . . . . . . . . 1SHC 5 . HD# parsed_1qg1 1
21 1 2 . . . . . . . . 1SHC 5 . HE# parsed_1qg1 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 . . . . . 1.8 1.80 9.62 parsed_1qg1 1
2 1 . . . . . 1.8 1.80 7.37 parsed_1qg1 1
3 1 . . . . . 1.8 1.80 9.66 parsed_1qg1 1
4 1 . . . . . 1.8 1.80 8.25 parsed_1qg1 1
5 1 . . . . . 1.8 1.80 6.55 parsed_1qg1 1
6 1 . . . . . 1.8 1.80 6.66 parsed_1qg1 1
7 1 . . . . . 1.8 1.80 6.90 parsed_1qg1 1
8 1 . . . . . 1.8 1.80 7.33 parsed_1qg1 1
9 1 . . . . . 1.8 1.80 7.09 parsed_1qg1 1
10 1 . . . . . 1.8 1.80 7.98 parsed_1qg1 1
11 1 . . . . . 1.8 1.80 7.57 parsed_1qg1 1
12 1 . . . . . 1.8 1.80 7.09 parsed_1qg1 1
13 1 . . . . . 1.8 1.80 6.99 parsed_1qg1 1
14 1 . . . . . 1.8 1.80 5.90 parsed_1qg1 1
15 1 . . . . . 1.8 1.80 6.78 parsed_1qg1 1
16 1 . . . . . 1.8 1.80 9.84 parsed_1qg1 1
17 1 . . . . . 1.8 1.80 10.60 parsed_1qg1 1
18 1 . . . . . 1.8 1.80 6.85 parsed_1qg1 1
19 1 . . . . . 1.8 1.80 6.78 parsed_1qg1 1
20 1 . . . . . 1.8 1.80 5.85 parsed_1qg1 1
21 1 . . . . . 1.8 1.80 5.90 parsed_1qg1 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
1 172 2 108 2 112 parsed_1qg1 1
2 191 4 108 4 112 parsed_1qg1 1
3 217 6 108 6 112 parsed_1qg1 1
4 218 8 108 8 112 parsed_1qg1 1
5 272 10 108 10 112 parsed_1qg1 1
6 276 12 108 12 112 parsed_1qg1 1
7 540 14 108 14 112 parsed_1qg1 1
8 545 16 108 16 112 parsed_1qg1 1
9 549 18 108 18 112 parsed_1qg1 1
10 566 20 108 20 112 parsed_1qg1 1
11 568 22 108 22 112 parsed_1qg1 1
12 725 24 108 24 112 parsed_1qg1 1
13 734 26 108 26 112 parsed_1qg1 1
14 868 28 108 28 112 parsed_1qg1 1
15 918 30 108 30 112 parsed_1qg1 1
16 1267 32 108 32 113 parsed_1qg1 1
17 1321 35 108 35 113 parsed_1qg1 1
18 1442 37 108 37 113 parsed_1qg1 1
19 1472 39 108 39 113 parsed_1qg1 1
20 1572 41 108 41 113 parsed_1qg1 1
21 1583 43 108 43 113 parsed_1qg1 1
stop_
save_
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