3K98

HSP90 N-terminal domain in complex with (1R)-2-(5-chloro-2,4-dihydroxybenzoyl)-N-ethylisoindoline-1-carboxamide

Summary for 3K98

• Entry DOI: 10.2210/pdb3k98/pdb
• Related: 3K97 3K99
• Descriptor: Heat shock protein HSP 90-alpha, (1R)-2-[(5-chloro-2,4-dihydroxyphenyl)carbonyl]-N-ethyl-2,3-dihydro-1H-isoindole-1-carboxamide, PHOSPHATE ION, ... (4 entities in total)
• Functional Keywords: hsp90, atp binding domain, inhibition, acetylation, alternative splicing, atp-binding, chaperone, cytoplasm, nucleotide-binding, phosphoprotein, stress response
• Biological source: Homo sapiens (human)
• Cellular location: Cytoplasm : P07900
• Total number of polymer chains: 2
• Total formula weight: 53640.01

Authors

Gajiwala, K.S.,Davies II, J.F. (deposition date: 2009-10-15, release date: 2010-02-09, Last modification date: 2024-02-21)

• Primary citation: Kung, P.P.,Huang, B.,Zhang, G.,Zhou, J.Z.,Wang, J.,Digits, J.A.,Skaptason, J.,Yamazaki, S.,Neul, D.,Zientek, M.,Elleraas, J.,Mehta, P.,Yin, M.J.,Hickey, M.J.,Gajiwala, K.S.,Rodgers, C.,Davies, J.F.,Gehring, M.R.; Dihydroxyphenylisoindoline amides as orally bioavailable inhibitors of the heat shock protein 90 (hsp90) molecular chaperone.; J.Med.Chem., 53:499-503, 2010; PubMed: 19908836; DOI: 10.1021/jm901209q

Experimental method

X-RAY DIFFRACTION (2.4 Å)