NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
43074 |
2a2b   |
6737 | cing | 2-parsed | STAR | distance | NOE | simple | 11 |
data_2a2b_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2a2b
_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_2a2b 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2a2b
_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 2a2b "Master copy" parsed_2a2b
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2a2b
_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 2a2b.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2a2b 1
1 2a2b.mr . . DYANA/DIANA 2 distance NOE simple 493 parsed_2a2b 1
1 2a2b.mr . . DYANA/DIANA 3 distance NOE simple 35 parsed_2a2b 1
1 2a2b.mr . . DYANA/DIANA 4 distance NOE simple 11 parsed_2a2b 1
1 2a2b.mr . . DYANA/DIANA 5 distance NOE simple 0 parsed_2a2b 1
1 2a2b.mr . . DYANA/DIANA 6 distance NOE simple 0 parsed_2a2b 1
1 2a2b.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2a2b 1
stop_
save_
save_DYANA/DIANA_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2a2b
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 4
_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_2a2b 1
2 1 . . . parsed_2a2b 1
3 1 . . . parsed_2a2b 1
4 1 . . . parsed_2a2b 1
5 1 . . . parsed_2a2b 1
6 1 . . . parsed_2a2b 1
7 1 . . . parsed_2a2b 1
8 1 . . . parsed_2a2b 1
9 1 . . . parsed_2a2b 1
10 1 . . . parsed_2a2b 1
11 1 . . . parsed_2a2b 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 . . . . . . . . . 4 TYR QD parsed_2a2b 1
1 1 2 . . . . . . . . . 8 VAL HB parsed_2a2b 1
2 1 1 . . . . . . . . . 16 TRP HD1 parsed_2a2b 1
2 1 2 . . . . . . . . . 19 ARG+ HB2 parsed_2a2b 1
3 1 1 . . . . . . . . . 26 ILE QG2 parsed_2a2b 1
3 1 2 . . . . . . . . . 27 ILE QG2 parsed_2a2b 1
4 1 1 . . . . . . . . . 9 TYR QD parsed_2a2b 1
4 1 2 . . . . . . . . . 16 TRP HE1 parsed_2a2b 1
5 1 1 . . . . . . . . . 32 SER HA parsed_2a2b 1
5 1 2 . . . . . . . . . 32 SER HB3 parsed_2a2b 1
6 1 1 . . . . . . . . . 14 LYS+ QZ parsed_2a2b 1
6 1 2 . . . . . . . . . 13 LYS+ QB parsed_2a2b 1
7 1 1 . . . . . . . . . 31 ILE HA parsed_2a2b 1
7 1 2 . . . . . . . . . 35 ALA QB parsed_2a2b 1
8 1 1 . . . . . . . . . 14 LYS+ QE parsed_2a2b 1
8 1 2 . . . . . . . . . 13 LYS+ QB parsed_2a2b 1
9 1 1 . . . . . . . . . 13 LYS+ QE parsed_2a2b 1
9 1 2 . . . . . . . . . 13 LYS+ QB parsed_2a2b 1
10 1 1 . . . . . . . . . 4 TYR HB3 parsed_2a2b 1
10 1 2 . . . . . . . . . 8 VAL HA parsed_2a2b 1
11 1 1 . . . . . . . . . 15 CYSS HN parsed_2a2b 1
11 1 2 . . . . . . . . . 11 ASN HB2 parsed_2a2b 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 . . . . . . . 6 parsed_2a2b 1
2 1 . . . . . . . 6 parsed_2a2b 1
3 1 . . . . . . . 6 parsed_2a2b 1
4 1 . . . . . . . 6 parsed_2a2b 1
5 1 . . . . . . . 4 parsed_2a2b 1
6 1 . . . . . . . 6 parsed_2a2b 1
7 1 . . . . . . . 6 parsed_2a2b 1
8 1 . . . . . . . 6 parsed_2a2b 1
9 1 . . . . . . . 6 parsed_2a2b 1
10 1 . . . . . . . 6 parsed_2a2b 1
11 1 . . . . . . . 6 parsed_2a2b 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 "toppen av gammel liste som ikke ble limt inn fste gang" 1 1 1 56 parsed_2a2b 1
2 "peak 75" 3 46 3 57 parsed_2a2b 1
3 "peak 76" 4 46 4 57 parsed_2a2b 1
4 "12 ASN HN 16 TRP HD1 6 #peak 300 #sty, bare p vre side av diag." 5 1 5 88 parsed_2a2b 1
5 "35 ALA HN 38 LEU HN 6 #peak 308" 6 1 6 59 parsed_2a2b 1
6 "9 TYR QD 12 ASN HB2 4 #peak 391" 7 1 7 58 parsed_2a2b 1
7 "peak 603 fra T23QG2/I26QG2" 8 46 8 74 parsed_2a2b 1
8 "9 TYR QD 16 TRP HD1 6 #peak 749 #liten topp, mulig sty. STY." 9 1 9 87 parsed_2a2b 1
9 "peak 776" 10 46 10 57 parsed_2a2b 1
10 "peak 818" 11 46 11 58 parsed_2a2b 1
11 "30 MET HN 35 ALA HN 6 #peak 992" 12 1 12 58 parsed_2a2b 1
12 "25 SER HN 30 MET HN 6 #peak 1030 #sty" 13 1 13 62 parsed_2a2b 1
13 "peak 1110" 14 46 14 58 parsed_2a2b 1
14 "peak 1173" 15 46 15 57 parsed_2a2b 1
15 "4 TYR HB2 8 VAL QG2 6 #peak 1239 # found elsewhere" 16 1 16 76 parsed_2a2b 1
16 "peak 1243" 17 46 17 58 parsed_2a2b 1
17 "peak 1244" 18 46 18 57 parsed_2a2b 1
18 "13 LYS+ HG2 15 CYSS HB2 6 #peak 1263 # Removed but why?" 19 1 19 76 parsed_2a2b 1
19 "peak 1281" 20 46 20 57 parsed_2a2b 1
20 "peak 1405#" 21 46 21 57 parsed_2a2b 1
stop_
save_
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