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Structure paper

TitleDesign and Synthesis of Dihydroxamic Acids as HDAC6/8/10 Inhibitors.
Journal, issue, pagesChemmedchem, Vol. 15, Page 1163-1174, Year 2020
Publish dateJan 29, 2020 (structure data deposition date)
AuthorsMorgen, M. / Steimbach, R.R. / Geraldy, M. / Hellweg, L. / Sehr, P. / Ridinger, J. / Witt, O. / Oehme, I. / Herbst-Gervasoni, C.J. / Osko, J.D. ...Morgen, M. / Steimbach, R.R. / Geraldy, M. / Hellweg, L. / Sehr, P. / Ridinger, J. / Witt, O. / Oehme, I. / Herbst-Gervasoni, C.J. / Osko, J.D. / Porter, N.J. / Christianson, D.W. / Gunkel, N. / Miller, A.K.
External linksChemmedchem / PubMed:32348628
MethodsX-ray diffraction
Resolution1.94301319072 - 2.05 Å
Structure data

PDB-6vnq:
Crystal Structure of Danio rerio Histone Deacetylase 10 in Complex with Bishydroxamic Acid Based Inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.05 Å

PDB-6vnr:
Crystal Structure of Danio rerio Histone Deacetylase 6 Catalytic Domain 2 (CD2) Complexed with Bishydroxamic Acid Inhibitor
Method: X-RAY DIFFRACTION / Resolution: 1.94301319072 Å

Chemicals

ChemComp-R5G:
N-hydroxy-1-{[4-(hydroxycarbamoyl)phenyl]methyl}-1H-indole-6-carboxamide

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-ZN:
Unknown entry

ChemComp-K:
Unknown entry

ChemComp-PO4:
PHOSPHATE ION

ChemComp-HOH:
WATER

Source
  • danio rerio (zebrafish)
KeywordsHydrolase/Hydrolase Inhibitor / Histone Deacetylase / Hydrolase-Hydrolase Inhibitor complex / metallohydrolase

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