NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
645673 |
6jxu   |
cing | 2-parsed | STAR | entry | full | 17 |
data_6jxu_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6jxu
_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_6jxu 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6jxu
_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 6jxu "Master copy" parsed_6jxu
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6jxu
_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 6jxu.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6jxu 1
1 6jxu.mr . . XPLOR/CNS 2 distance NOE simple 17 parsed_6jxu 1
1 6jxu.mr . . "MR format" 3 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6jxu 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_6jxu
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 1
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
*HEADER PROTEIN BINDING/PEPTIDE 25-APR-19 6JXU
*TITLE SUMO1 BOUND TO SLS4-SIM PEPTIDE FROM ICP0
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: SMALL UBIQUITIN-RELATED MODIFIER;
*COMPND 3 CHAIN: A;
*COMPND 4 SYNONYM: SUMO;
*COMPND 5 ENGINEERED: YES;
*COMPND 6 MOL_ID: 2;
*COMPND 7 MOLECULE: VIRAL PROTEIN;
*COMPND 8 CHAIN: B;
*COMPND 9 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE 3 ORGANISM_COMMON: HUMAN;
*SOURCE 4 ORGANISM_TAXID: 9606;
*SOURCE 5 GENE: SUMO1;
*SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE 8 MOL_ID: 2;
*SOURCE 9 SYNTHETIC: YES;
*SOURCE 10 ORGANISM_SCIENTIFIC: HUMAN HERPESVIRUS 1;
*SOURCE 11 ORGANISM_TAXID: 10298
*KEYWDS SUMOYLATION, PROTEIN BINDING-PEPTIDE COMPLEX
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR D.S.S.HEMBRAM,H.NEGI,D.SHET,R.DAS
*REVDAT 1 05-FEB-20 6JXU 0
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6jxu
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_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_6jxu 1
2 1 . . . parsed_6jxu 1
3 1 . . . parsed_6jxu 1
4 1 . . . parsed_6jxu 1
5 1 . . . parsed_6jxu 1
6 1 . . . parsed_6jxu 1
7 1 . . . parsed_6jxu 1
8 1 . . . parsed_6jxu 1
9 1 . . . parsed_6jxu 1
10 1 . . . parsed_6jxu 1
11 1 . . . parsed_6jxu 1
12 1 . . . parsed_6jxu 1
13 1 . . . parsed_6jxu 1
14 1 . . . parsed_6jxu 1
15 1 . . . parsed_6jxu 1
16 1 . . . parsed_6jxu 1
17 1 . . . parsed_6jxu 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 . . . . . . . . A 33 . HN parsed_6jxu 1
1 1 2 . . . . . . . . B 359 . HB1 parsed_6jxu 1
2 1 1 . . . . . . . . A 33 . HN parsed_6jxu 1
2 1 2 . . . . . . . . B 358 . HB1 parsed_6jxu 1
3 1 1 . . . . . . . . A 33 . HN parsed_6jxu 1
3 1 2 . . . . . . . . B 358 . HD21 parsed_6jxu 1
4 1 1 . . . . . . . . A 33 . HN parsed_6jxu 1
4 1 2 . . . . . . . . B 359 . HN parsed_6jxu 1
5 1 1 . . . . . . . . A 35 . HN parsed_6jxu 1
5 1 2 . . . . . . . . B 360 . HA parsed_6jxu 1
6 1 1 . . . . . . . . A 35 . HN parsed_6jxu 1
6 1 2 . . . . . . . . B 360 . HB1 parsed_6jxu 1
7 1 1 . . . . . . . . A 37 . HN parsed_6jxu 1
7 1 2 . . . . . . . . B 363 . HA parsed_6jxu 1
8 1 1 . . . . . . . . A 37 . HN parsed_6jxu 1
8 1 2 . . . . . . . . B 362 . HB parsed_6jxu 1
9 1 1 . . . . . . . . A 37 . HN parsed_6jxu 1
9 1 2 . . . . . . . . B 362 . HG12 parsed_6jxu 1
10 1 1 . . . . . . . . A 37 . HN parsed_6jxu 1
10 1 2 . . . . . . . . B 362 . HG13 parsed_6jxu 1
11 1 1 . . . . . . . . A 37 . HN parsed_6jxu 1
11 1 2 . . . . . . . . B 362 . HD11 parsed_6jxu 1
12 1 1 . . . . . . . . A 37 . HN parsed_6jxu 1
12 1 2 . . . . . . . . B 361 . HD1 parsed_6jxu 1
13 1 1 . . . . . . . . A 37 . HN parsed_6jxu 1
13 1 2 . . . . . . . . B 361 . HB1 parsed_6jxu 1
14 1 1 . . . . . . . . A 51 . HN parsed_6jxu 1
14 1 2 . . . . . . . . B 362 . HD11 parsed_6jxu 1
15 1 1 . . . . . . . . A 51 . HN parsed_6jxu 1
15 1 2 . . . . . . . . B 362 . HA parsed_6jxu 1
16 1 1 . . . . . . . . A 47 . HN parsed_6jxu 1
16 1 2 . . . . . . . . B 364 . HG21 parsed_6jxu 1
17 1 1 . . . . . . . . A 54 . HN parsed_6jxu 1
17 1 2 . . . . . . . . B 364 . HG21 parsed_6jxu 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 . . . . . 4.0 2.2 4.5 parsed_6jxu 1
2 1 . . . . . 5.0 3.2 5.5 parsed_6jxu 1
3 1 . . . . . 6 4.2 6.5 parsed_6jxu 1
4 1 . . . . . 4.5 2.7 5.0 parsed_6jxu 1
5 1 . . . . . 4.0 2.2 4.5 parsed_6jxu 1
6 1 . . . . . 5.0 3.2 5.5 parsed_6jxu 1
7 1 . . . . . 6.0 4.2 6.5 parsed_6jxu 1
8 1 . . . . . 5.0 3.2 5.5 parsed_6jxu 1
9 1 . . . . . 6.0 4.2 6.5 parsed_6jxu 1
10 1 . . . . . 6.0 4.2 6.5 parsed_6jxu 1
11 1 . . . . . 6.0 4.2 6.5 parsed_6jxu 1
12 1 . . . . . 6.0 4.2 6.5 parsed_6jxu 1
13 1 . . . . . 6.0 4.2 6.5 parsed_6jxu 1
14 1 . . . . . 6.0 4.2 6.5 parsed_6jxu 1
15 1 . . . . . 6.0 4.2 6.5 parsed_6jxu 1
16 1 . . . . . 7.0 5.2 7.5 parsed_6jxu 1
17 1 . . . . . 7.0 5.2 7.5 parsed_6jxu 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 "# Restraints file 1: xplor-Intnoes-SUMO1-SLS4.list" 1 1 1 50 parsed_6jxu 1
stop_
save_
Contact the webmaster for help, if required. Sunday, May 19, 2024 2:35:16 AM GMT (wattos1)