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Structure paper

TitleTargeted Degradation of PARP14 Using a Heterobifunctional Small Molecule.
Journal, issue, pagesChembiochem, Vol. 22, Page 2107-2110, Year 2021
Publish dateJan 5, 2021 (structure data deposition date)
AuthorsWigle, T.J. / Ren, Y. / Molina, J.R. / Blackwell, D.J. / Schenkel, L.B. / Swinger, K.K. / Kuplast-Barr, K. / Majer, C.R. / Church, W.D. / Lu, A.Z. ...Wigle, T.J. / Ren, Y. / Molina, J.R. / Blackwell, D.J. / Schenkel, L.B. / Swinger, K.K. / Kuplast-Barr, K. / Majer, C.R. / Church, W.D. / Lu, A.Z. / Mo, J. / Abo, R. / Cheung, A. / Dorsey, B.W. / Niepel, M. / Perl, N.R. / Vasbinder, M.M. / Keilhack, H. / Kuntz, K.W.
External linksChembiochem / PubMed:33838082
MethodsX-ray diffraction
Resolution2.25 - 2.57 Å
Structure data

PDB-7l9y:
Human PARP14 (ARTD8), catalytic fragment in complex with RBN012042
Method: X-RAY DIFFRACTION / Resolution: 2.25 Å

PDB-7lun:
Human PARP14 (ARTD8), catalytic fragment in complex with RBN011980
Method: X-RAY DIFFRACTION / Resolution: 2.57 Å

Chemicals

ChemComp-XRM:
7-(cyclopentylamino)-5-fluoro-2-{[(piperidin-4-yl)sulfanyl]methyl}quinazolin-4(3H)-one

ChemComp-CL:
Unknown entry

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-HOH:
WATER

ChemComp-YFG:
7-(cyclopentylamino)-5-fluoro-2-{[(trans-4-hydroxycyclohexyl)sulfanyl]methyl}quinazolin-4(3H)-one

ChemComp-GOL:
GLYCEROL

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/Inhibitor / PARP14 / ARTD8 / monoPARP / ADP ribosylation / inhibitor complex / TRANSFERASE-Inhibitor complex / TRANSFERASE

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