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Structure paper

TitleInhibition of HSP90 with pochoximes: SAR and structure-based insights.
Journal, issue, pagesChembiochem, Vol. 10, Page 2753-2759, Year 2009
Publish dateAug 13, 2009 (structure data deposition date)
AuthorsBarluenga, S. / Fontaine, J.G. / Wang, C. / Aouadi, K. / Chen, R. / Beebe, K. / Neckers, L. / Winssinger, N.
External linksChembiochem / PubMed:19856365
MethodsX-ray diffraction
Resolution1.75 - 1.95 Å
Structure data

PDB-3inw:
HSP90 N-TERMINAL DOMAIN with pochoxime A
Method: X-RAY DIFFRACTION / Resolution: 1.95 Å

PDB-3inx:
HSP90 N-TERMINAL DOMAIN with pochoxime B
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

Chemicals

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

ChemComp-JZB:
(5E,9E,11E)-13-chloro-14,16-dihydroxy-3,4,7,8-tetrahydro-1H-2-benzoxacyclotetradecine-1,11(12H)-dione 11-[O-(2-oxo-2-piperidin-1-ylethyl)oxime]

ChemComp-HOH:
WATER

ChemComp-JZC:
(5E,9E,11E)-14,16-dihydroxy-3,4,7,8-tetrahydro-1H-2-benzoxacyclotetradecine-1,11(12H)-dione 11-[O-(2-oxo-2-piperidin-1-ylethyl)oxime]

Source
  • homo sapiens (human)
KeywordsCHAPERONE / Alpha Beta / 2-Layer Sandwich / ATP-binding / Nucleotide-binding / Phosphoprotein / Stress response / SP / RAL / radicicol / pochonin / pochoxime

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