2XAB

Structure of HSP90 with an inhibitor bound

Summary for 2XAB

• Entry DOI: 10.2210/pdb2xab/pdb
• Related: 1BYQ 1OSF 1UY6 1UY7 1UY8 1UY9 1UYC 1UYD 1UYE 1UYF 1UYG 1UYH 1UYI 1UYK 1UYL 1YC1 1YC3 1YC4 1YER 1YES 1YET 2BSM 2BT0 2BUG 2BYH 2BYI 2BZ5 2C2L 2CCS 2CCT 2CCU 2CDD 2FWY 2FWZ 2JJC 2UWD 2VCI 2VCJ 2WI1 2WI2 2WI3 2WI4 2WI5 2WI6 2WI7
• Descriptor: HEAT SHOCK PROTEIN HSP 90-ALPHA,, 4-(1,3-DIHYDRO-2H-ISOINDOL-2-YLCARBONYL)-6-(1-METHYLETHYL)BENZENE-1,3-DIOL (3 entities in total)
• Functional Keywords: cancer, chaperone, atp-binding, nucleotide-binding, stress response
• Biological source: HOMO SAPIENS (HUMAN)
• Cellular location: Nucleus : P07900
• Total number of polymer chains: 2
• Total formula weight: 56513.37

Authors

Murray, C.W.,Carr, M.G.,Callaghan, O.,Chessari, G.,Congreve, m.,Cowan, S.,Coyle, J.E.,Downham, R.,Figueroa, E.,Frederickson, M.,Graham, B.,McMenamin, R.,O'Brian, M.A.,Patel, S.,Phillips, T.R.,Williams, G.,Woodhead, A.J.,Woolford, A.J.A. (deposition date: 2010-03-30, release date: 2010-08-11, Last modification date: 2018-04-04)

• Primary citation: Woodhead, A.J.,Angove, H.,Carr, M.G.,Chessari, G.,Congreve, M.,Coyle, J.E.,Cosme, J.,Graham, B.,Day, P.J.,Downham, R.,Fazal, L.,Feltell, R.,Figueroa, E.,Frederickson, M.,Lewis, J.,Mcmenamin, R.,Murray, C.W.,O'Brien, M.A.,Parra, L.,Patel, S.,Phillips, T.,Rees, D.C.,Rich, S.,Smith, D.,Trewartha, G.,Vinkovic, M.,Williams, B.,Woolford, A.J.; Discovery of (2,4-Dihydroxy-5-Isopropylphenyl)-[5-(4-Methylpiperazin-1-Ylmethyl)-1,3-Dihydroisoindol-2-Yl]Methanone (at13387), a Novel Inhibitor of the Molecular Chaperone Hsp90 by Fragment Based Drug Design.; J.Med.Chem., 53:5956-, 2010; PubMed: 20662534; DOI: 10.1021/JM100060B

Experimental method

X-RAY DIFFRACTION (1.9 Å)