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TitleA selective small-molecule STAT5 PROTAC degrader capable of achieving tumor regression in vivo.
Journal, issue, pagesNat. Chem. Biol., Vol. 19, Page 703-711, Year 2023
Publish dateFeb 4, 2022 (structure data deposition date)
AuthorsKaneshige, A. / Bai, L. / Wang, M. / McEachern, D. / Meagher, J.L. / Xu, R. / Wang, Y. / Jiang, W. / Metwally, H. / Kirchhoff, P.D. ...Kaneshige, A. / Bai, L. / Wang, M. / McEachern, D. / Meagher, J.L. / Xu, R. / Wang, Y. / Jiang, W. / Metwally, H. / Kirchhoff, P.D. / Zhao, L. / Jiang, H. / Wen, B. / Sun, D. / Stuckey, J.A. / Wang, S.
External linksNat. Chem. Biol. / PubMed:36732620
MethodsX-ray diffraction
Resolution2.653 - 2.835 Å
Structure data

PDB-7tva:
Stat5a Core in complex with AK2292
Method: X-RAY DIFFRACTION / Resolution: 2.835 Å

PDB-7tvb:
Stat5A Core in Complex with AK305
Method: X-RAY DIFFRACTION / Resolution: 2.653 Å

Chemicals

ChemComp-KOO:
N-{5-[difluoro(phosphono)methyl]-1-benzothiophene-2-carbonyl}-3-methyl-L-valyl-L-prolyl-N-(5-{2-[(3R)-2,6-dioxopiperidin-3-yl]-1-oxo-2,3-dihydro-1H-isoindol-4-yl}pent-4-yn-1-yl)-N-methyl-N~3~-[4-(1,3-thiazol-2-yl)phenyl]-beta-alaninamide

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

ChemComp-MLI:
MALONATE ION

ChemComp-HOH:
WATER

ChemComp-KOC:
N-{5-[difluoro(phosphono)methyl]-1-benzothiophene-2-carbonyl}-3-methyl-L-valyl-L-prolyl-N,N-dimethyl-N~3~-[4-(1,3-thiazol-2-yl)phenyl]-beta-alaninamide

ChemComp-GOL:
GLYCEROL

Source
  • homo sapiens (human)
KeywordsTRANSCRIPTION / Stat5a / Activator

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