3HEK

HSP90 N-terminal domain in complex with 1-{4-[(2R)-1-(5-chloro-2,4-dihydroxybenzoyl)pyrrolidin-2-yl]benzyl}-3,3-difluoropyrrolidinium

Summary for 3HEK

Entry DOI	10.2210/pdb3hek/pdb
Descriptor	Heat shock protein HSP 90-alpha, [(2~{R})-2-[4-[[3,3-bis(fluoranyl)pyrrolidin-1-yl]methyl]phenyl]pyrrolidin-1-yl]-[5-chloranyl-2,4-bis(oxidanyl)phenyl]methanone, PHOSPHATE ION, ... (4 entities in total)
Functional Keywords	hsp90, 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	52134.43
Authors	Gajiwala, K.S. (deposition date: 2009-05-08, release date: 2009-09-29, Last modification date: 2024-04-03)
Primary citation	Cho-Schultz, S.,Patten, M.J.,Huang, B.,Elleraas, J.,Gajiwala, K.S.,Hickey, M.J.,Wang, J.,Mehta, P.P.,Kang, P.,Gehring, M.R.,Kung, P.P.,Sutton, S.C. Solution-phase parallel synthesis of Hsp90 inhibitors J.Comb.Chem., 11:860-874, Cited by PubMed: 19583220 DOI: 10.1021/cc900056d PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.95 Å)

Structure validation