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TitleNRX-0492 degrades wild-type and C481 mutant BTK and demonstrates in vivo activity in CLL patient-derived xenografts.
Journal, issue, pagesBlood, Vol. 141, Page 1584-1596, Year 2023
Publish dateSep 16, 2022 (structure data deposition date)
AuthorsZhang, D. / Harris, H.M. / Chen, J. / Judy, J. / James, G. / Kelly, A. / McIntosh, J. / Tenn-McClellan, A. / Ambing, E. / Tan, Y.S. ...Zhang, D. / Harris, H.M. / Chen, J. / Judy, J. / James, G. / Kelly, A. / McIntosh, J. / Tenn-McClellan, A. / Ambing, E. / Tan, Y.S. / Lu, H. / Gajewski, S. / Clifton, M.C. / Yung, S. / Robbins, D.W. / Pirooznia, M. / Skanland, S.S. / Gaglione, E. / Mhibik, M. / Underbayev, C. / Ahn, I.E. / Sun, C. / Herman, S.E.M. / Noviski, M. / Wiestner, A.
External linksBlood / PubMed:36375120
MethodsX-ray diffraction
Resolution1.58 Å
Structure data

PDB-8ejb:
Bruton's tyrosine kinase in complex with 3-{[4-(1-acetylpiperidin-4-yl)phenyl]amino}-5-[(3R)-3-(3-methyl-2-oxoimidazolidin-1-yl)piperidin-1-yl]pyrazine-2-carboxamide
Method: X-RAY DIFFRACTION / Resolution: 1.58 Å

Chemicals

ChemComp-WKC:
5-[(3R)-3-(3-methyl-2-oxoimidazolidin-1-yl)piperidin-1-yl]-3-[4-(piperidin-4-yl)anilino]pyrazine-2-carboxamide

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-PD:
PALLADIUM ION

ChemComp-CL:
Unknown entry

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE / protein degradation / leukemia

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