Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type |
|
|
43818 | 2btx RC | 4195 | cing | 2-parsed | STAR | comment |
data_2btx_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2btx
_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_2btx 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2btx
_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 2btx "Master copy" parsed_2btx
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2btx
_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 2btx.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2btx 1
1 2btx.mr . . XPLOR/CNS 2 distance "general distance" simple 0 parsed_2btx 1
1 2btx.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2btx 1
1 2btx.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_2btx 1
1 2btx.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2btx 1
1 2btx.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2btx 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_2btx
_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 COMPLEX (TOXIN/PEPTIDE) 23-AUG-98 2BTX
*TITLE SOLUTION NMR STRUCTURE OF THE COMPLEX OF ALPHA-BUNGAROTOXIN
*TITLE 2 WITH A LIBRARY DERIVED PEPTIDE, NMR, MINIMIZED AVERAGE
*TITLE 3 STRUCTURE
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: ALPHA-BUNGAROTOXIN;
*COMPND 3 CHAIN: A;
*COMPND 4 BIOLOGICAL_UNIT: MONOMER;
*COMPND 5 MOL_ID: 2;
*COMPND 6 MOLECULE:
*COMPND 7 MET-ARG-TYR-TYR-GLU-SER-SER-LEU-LYS-SER-TYR-PRO-ASP;
*COMPND 8 CHAIN: B;
*COMPND 9 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: BUNGARUS MULTICINCTUS;
*SOURCE 3 ORGANISM_COMMON: SNAKE, MANY-BANDED KRAIT;
*SOURCE 4 SECRETION: VENOM;
*SOURCE 5 MOL_ID: 2;
*SOURCE 6 SYNTHETIC: DERIVED FROM A PHAGE-DISPLAYED PEPTIDE LIBRARY
*KEYWDS COMPLEX (TOXIN/PEPTIDE), ALPHA-BUNGAROTOXIN, LIBRARY PEPTIDE
*EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE
*AUTHOR T.SCHERF,M.BALASS,S.FUCHS,E.KATCHALSKI-KATZIR,J.ANGLISTER
*REVDAT 1 12-OCT-04 2BTX 0
!A LIST OF ALL NMR CONSTRAINTS USED TO CALCULATE THE THREE-DIMENSIONAL SOLUTION
!STRUCTURE OF THE COMPLEX OF a-BUNGAROTOXIN WITH A LIBRARY-DERIVED PEPTIDE.
!THESE CONSTRAINTS CONSISTED OF 941 INTRAMOLECULAR
!CONSTRAINTS WITHIN THE BOUND TOXIN (INCLUDING 291 LONG-RANGE
!INTERACTIONS), 98 INTRAPEPTIDE INTERACTIONS (INCLUDING 7 LONG-
!RANGE INTERACTIONS), AND 62 INTERMOLECULAR CONSTRAINTS BETWEEN
!THE BUNGAROTOXIN AND THE 13-RESIDUE PEPTIDE USED IN THIS
!STUDY (LISTED HERE AS RESIDUES 75 - 87).
;
save_