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TitleDiscovery of a New Isoxazole-3-hydroxamate-Based Histone Deacetylase 6 Inhibitor SS-208 with Antitumor Activity in Syngeneic Melanoma Mouse Models.
Journal, issue, pagesJ. Med. Chem., Vol. 62, Page 8557-8577, Year 2019
Publish dateMar 13, 2019 (structure data deposition date)
AuthorsShen, S. / Hadley, M. / Ustinova, K. / Pavlicek, J. / Knox, T. / Noonepalle, S. / Tavares, M.T. / Zimprich, C.A. / Zhang, G. / Robers, M.B. ...Shen, S. / Hadley, M. / Ustinova, K. / Pavlicek, J. / Knox, T. / Noonepalle, S. / Tavares, M.T. / Zimprich, C.A. / Zhang, G. / Robers, M.B. / Barinka, C. / Kozikowski, A.P. / Villagra, A.
External linksJ. Med. Chem. / PubMed:31414801
MethodsX-ray diffraction
Resolution1.15 Å
Structure data

PDB-6r0k:
X-ray structure of Danio rerio histone deacetylase 6 (HDAC6) CD2 in complex with a inhibitor SS208
Method: X-RAY DIFFRACTION / Resolution: 1.15 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-K:
Unknown entry

ChemComp-JNN:
5-[2-[(3,4-dichlorophenyl)carbonylamino]ethyl]-~{N}-oxidanyl-1,2-oxazole-3-carboxamide

ChemComp-SCN:
THIOCYANATE ION

ChemComp-HOH:
WATER

Source
  • danio rerio (zebrafish)
KeywordsHYDROLASE / protein deacetylase / histone deacetylase 6 / Zinc-binding / isoxazole-3-hydroxamate analogues

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