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Structure paper

TitleSelective Class Iia Histone Deacetylase Inhibition Via a Non-Chelating Zinc Binding Group
Journal, issue, pagesNat. Chem. Biol., Vol. 9, Page 319-, Year 2013
Publish dateFeb 15, 2013 (structure data deposition date)
AuthorsLobera, M. / Madauss, K.P. / Pohlhaus, D.T. / Wright, Q.G. / Trocha, M. / Schmidt, D.R. / Baloglu, E. / Trump, R.P. / Head, M.S. / Hofmann, G.A. ...Lobera, M. / Madauss, K.P. / Pohlhaus, D.T. / Wright, Q.G. / Trocha, M. / Schmidt, D.R. / Baloglu, E. / Trump, R.P. / Head, M.S. / Hofmann, G.A. / Murray-Thompson, M. / Schwartz, B. / Chakravorty, S. / Wu, Z. / Mander, P.K. / Kruidenier, L. / Reid, R.A. / Burkhart, W. / Turunen, B.J. / Rong, J.X. / Wagner, C. / Moyer, M.B. / Wells, C. / Hong, X. / Moore, J.T. / Williams, J.D. / Soler, D. / Ghosh, S. / Nolan, M.A.
External linksNat. Chem. Biol. / PubMed:23524983
MethodsX-ray diffraction
Resolution2.4 - 2.45 Å
Structure data

PDB-3znr:
HDAC7 bound with inhibitor TMP269
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

PDB-3zns:
HDAC7 bound with TFMO inhibitor tmp942
Method: X-RAY DIFFRACTION / Resolution: 2.45 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-K:
Unknown entry

ChemComp-NU9:
N-{[4-(4-phenyl-1,3-thiazol-2-yl)tetrahydro-2H-pyran-4-yl]methyl}-3-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]benzamide

ChemComp-HOH:
WATER

ChemComp-NU7:
N-{[1-methyl-4-(4-phenyl-1,3-thiazol-2-yl)piperidin-4-yl]methyl}-3-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]benzamide

Source
  • homo sapiens (human)
KeywordsHYDROLASE / CLASS IIA HDACS / TFMO / ZBG / MBG

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