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TitleMechanism-based inhibitors of SIRT2: structure-activity relationship, X-ray structures, target engagement, regulation of alpha-tubulin acetylation and inhibition of breast cancer cell migration.
Journal, issue, pagesRsc Chem Biol, Vol. 2, Page 612-626, Year 2021
Publish dateMar 19, 2020 (structure data deposition date)
AuthorsNielsen, A.L. / Rajabi, N. / Kudo, N. / Lundo, K. / Moreno-Yruela, C. / Baek, M. / Fontenas, M. / Lucidi, A. / Madsen, A.S. / Yoshida, M. / Olsen, C.A.
External linksRsc Chem Biol / PubMed:34458803
MethodsX-ray diffraction
Resolution1.7 Å
Structure data

PDB-7bos:
Human SIRT2 in complex with myristoyl thiourea inhibitor, No.13
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

PDB-7bot:
Human SIRT2 in complex with myristoyl thiourea inhibitor, No.23
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-F4R:
N-dodecylmethanethioamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
  • synthetic construct (others)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / NAD-dependent deacetylase / deacylase / inhibitor complex / TRANSFERASE / TRANSFERASE-TRANSFERASE INHIBITOR complex

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