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TitleDiscovery of Potent Isoindolinone Inhibitors that Target an Active Conformation of PARP1 Using DNA-Encoded Libraries.
Journal, issue, pagesChemmedchem, Vol. 19, Page e202400093-e202400093, Year 2024
Publish dateSep 11, 2023 (structure data deposition date)
AuthorsMcCarthy, K.A. / Marcotte, D.J. / Parelkar, S. / McKinnon, C.L. / Trammell, L.E. / Stangeland, E.L. / Jetson, R.R.
External linksChemmedchem / PubMed:38482564
MethodsX-ray diffraction
Resolution3.02 Å
Structure data

PDB-8u4w:
The crystal structure of a helical domain deleted PARP1 in complex with isoindolinone based inhibitor.
Method: X-RAY DIFFRACTION / Resolution: 3.02 Å

Chemicals


ChemComp, No image

ChemComp-VHU:
Unknown entry

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / PARP1 / TRANSFERASE / TRANSFERASE-TRANSFERASE INHIBITOR complex

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