NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
632343 |
6cus   |
30404 | cing | 2-parsed | STAR | entry | full | 5 |
data_6cus_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6cus
_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_6cus 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6cus
_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 6cus "Master copy" parsed_6cus
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6cus
_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 6cus.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6cus 1
1 6cus.mr . . XPLOR/CNS 2 distance NOE simple 5 parsed_6cus 1
1 6cus.mr . . HADDOCK 3 distance NOE ambi 0 parsed_6cus 1
1 6cus.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6cus 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_6cus
_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 VIRAL PROTEIN 26-MAR-18 6CUS
*TITLE HADDOCK STRUCTURE OF THE ROUS SARCOMA VIRUS MATRIX PROTEIN (M-DOMAIN)
*TITLE 2 IN COMPLEX WITH MYO-INOSITOL HEXAKISPHOSPHATE
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: MATRIX PROTEIN P19;
*COMPND 3 CHAIN: A;
*COMPND 4 ENGINEERED: YES;
*COMPND 5 MUTATION: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: ROUS SARCOMA VIRUS;
*SOURCE 3 ORGANISM_COMMON: RSV-PRC;
*SOURCE 4 ORGANISM_TAXID: 11888;
*SOURCE 5 STRAIN: PRAGUE C;
*SOURCE 6 GENE: GAG-POL;
*SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 8 EXPRESSION_SYSTEM_TAXID: 562
*KEYWDS RSV, ASV, GAG, IP6, VIRAL PROTEIN
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR J.VLACH,J.S.SAAD
*REVDAT 1 24-OCT-18 6CUS 0
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6cus
_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 2 . OR parsed_6cus 1
1 2 . 3 . parsed_6cus 1
1 3 . . . parsed_6cus 1
2 1 2 . OR parsed_6cus 1
2 2 . 3 . parsed_6cus 1
2 3 . 4 . parsed_6cus 1
2 4 . . . parsed_6cus 1
3 1 . . . parsed_6cus 1
4 1 2 . OR parsed_6cus 1
4 2 . 3 . parsed_6cus 1
4 3 . . . parsed_6cus 1
5 1 2 . OR parsed_6cus 1
5 2 . 3 . parsed_6cus 1
5 3 . . . parsed_6cus 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 2 1 . . . . . . . . A 23 . HE# parsed_6cus 1
1 2 2 . . . . . . . . B . . H40 parsed_6cus 1
1 3 1 . . . . . . . . A 23 . HE# parsed_6cus 1
1 3 2 . . . . . . . . B . . H42 parsed_6cus 1
2 2 1 . . . . . . . . A 23 . HE# parsed_6cus 1
2 2 2 . . . . . . . . B . . H37 parsed_6cus 1
2 3 1 . . . . . . . . A 23 . HE# parsed_6cus 1
2 3 2 . . . . . . . . B . . H39 parsed_6cus 1
2 4 1 . . . . . . . . A 23 . HE# parsed_6cus 1
2 4 2 . . . . . . . . B . . H41 parsed_6cus 1
3 1 1 . . . . . . . . A 23 . HE# parsed_6cus 1
3 1 2 . . . . . . . . B . . H38 parsed_6cus 1
4 2 1 . . . . . . . . A 23 . HD# parsed_6cus 1
4 2 2 . . . . . . . . B . . H40 parsed_6cus 1
4 3 1 . . . . . . . . A 23 . HD# parsed_6cus 1
4 3 2 . . . . . . . . B . . H42 parsed_6cus 1
5 2 1 . . . . . . . . A 13 . HE# parsed_6cus 1
5 2 2 . . . . . . . . B . . H40 parsed_6cus 1
5 3 1 . . . . . . . . A 13 . HE# parsed_6cus 1
5 3 2 . . . . . . . . B . . H42 parsed_6cus 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 2 . . . . . 4.0 1.8 5.5 parsed_6cus 1
1 3 . . . . . 4.0 1.8 5.5 parsed_6cus 1
2 2 . . . . . 5.0 1.8 7.0 parsed_6cus 1
2 3 . . . . . 5.0 1.8 7.0 parsed_6cus 1
2 4 . . . . . 5.0 1.8 7.0 parsed_6cus 1
3 1 . . . . . 5.0 1.8 7.0 parsed_6cus 1
4 2 . . . . . 4.0 1.8 5.5 parsed_6cus 1
4 3 . . . . . 4.0 1.8 5.5 parsed_6cus 1
5 2 . . . . . 5.0 1.8 7.0 parsed_6cus 1
5 3 . . . . . 5.0 1.8 7.0 parsed_6cus 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
;
IHP-12 hydrogens: 1-H37, 2-H38, 3-H39, 4-H40, 5-H41, 6-H42
Lys23 HE*
;
2 1 4 11 parsed_6cus 1
2 "Lys23 HD*" 14 1 14 11 parsed_6cus 1
3 "Lys13 HE*" 18 1 18 11 parsed_6cus 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: noe_combined.tbl" 1 1 1 37 parsed_6cus 1
stop_
save_
Contact the webmaster for help, if required. Sunday, April 28, 2024 10:16:28 AM GMT (wattos1)