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Structure paper

TitleDiscovery of an Anion-Dependent Farnesyltransferase Inhibitor from a Phenotypic Screen.
Journal, issue, pagesACS Med Chem Lett, Vol. 12, Page 99-106, Year 2021
Publish dateJul 29, 2021 (structure data deposition date)
AuthorsBukhtiyarova, M. / Cook, E.M. / Hancock, P.J. / Hruza, A.W. / Shaw, A.W. / Adam, G.C. / Barnard, R.J.O. / McKenna, P.M. / Holloway, M.K. / Bell, I.M. ...Bukhtiyarova, M. / Cook, E.M. / Hancock, P.J. / Hruza, A.W. / Shaw, A.W. / Adam, G.C. / Barnard, R.J.O. / McKenna, P.M. / Holloway, M.K. / Bell, I.M. / Carroll, S. / Cornella-Taracido, I. / Cox, C.D. / Kutchukian, P.S. / Powell, D.A. / Strickland, C. / Trotter, B.W. / Tudor, M. / Wolkenberg, S. / Li, J. / Tellers, D.M.
External linksACS Med Chem Lett / PubMed:33488970
MethodsX-ray diffraction
Resolution1.978 - 2.28 Å
Structure data

PDB-7rn5:
Discovery of an Anion-Dependent Farnesyltransferase Inhibitor from a Phenotypic Screen
Method: X-RAY DIFFRACTION / Resolution: 2.28 Å

PDB-7rni:
Discovery of an Anion-Dependent Farnesyltransferase Inhibitor from a Phenotypic Screen
Method: X-RAY DIFFRACTION / Resolution: 1.978 Å

Chemicals

ChemComp-ACE:
ACETYL GROUP

ChemComp-60I:
[4-[[3-(2,2-dimethylpropyl)-1~{H}-benzimidazol-2-yl]methyl]piperazin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone

ChemComp-ZN:
Unknown entry

ChemComp-MG:
Unknown entry

ChemComp-PPV:
PYROPHOSPHATE

ChemComp-HOH:
WATER

ChemComp-DMA:
DIMETHYLALLYL DIPHOSPHATE

Source
  • rattus norvegicus (Norway rat)
KeywordsTRANSFERASE/INHIBITOR / PROTEIN INHIBITOR COMPLEX / TRANSFERASE-TRANSFERASE INHIBITOR COMPLEX / TRANSFERASE / TRANSFERASE-INHIBITOR complex

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