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TitleIdentification and Evaluation of Reversible Covalent Binders to Cys55 of Bfl-1 from a DNA-Encoded Chemical Library Screen.
Journal, issue, pagesAcs Med. Chem. Lett., Vol. 15, Page 791-797, Year 2024
Publish dateJan 16, 2024 (structure data deposition date)
AuthorsLucas, S.C.C. / Blackwell, J.H. / Borjesson, U. / Hargreaves, D. / Milbradt, A.G. / Ahmed, S. / Bostock, M.J. / Guerot, C. / Gohlke, A. / Kinzel, O. ...Lucas, S.C.C. / Blackwell, J.H. / Borjesson, U. / Hargreaves, D. / Milbradt, A.G. / Ahmed, S. / Bostock, M.J. / Guerot, C. / Gohlke, A. / Kinzel, O. / Lamb, M.L. / Selmi, N. / Stubbs, C.J. / Su, N. / Su, Q. / Luo, H. / Xiong, T. / Zuo, X. / Bazzaz, S. / Bienstock, C. / Centrella, P.A. / Denton, K.E. / Gikunju, D. / Guie, M.A. / Guilinger, J.P. / Hupp, C. / Keefe, A.D. / Satoh, T. / Zhang, Y. / Rivers, E.L.
External linksAcs Med. Chem. Lett. / PubMed:38894895
MethodsX-ray diffraction
Resolution1.791 Å
Structure data

PDB-8rpo:
BFL1 in complex with a reversible covalent ligand
Method: X-RAY DIFFRACTION / Resolution: 1.791 Å

Chemicals

PDB-1h2c:
Ebola virus matrix protein VP40 N-terminal domain in complex with RNA (High-resolution VP40[55-194] variant).

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsAPOPTOSIS / BFL BCL covalent

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