PDB Information

PDB3R4N
MethodX-RAY DIFFRACTION
Host OrganismEscherichia coli
Gene SourceHomo sapiens
Primary Citation
Optimization of potent, selective, and orally bioavailable pyrrolodinopyrimidine-containing inhibitors of heat shock protein 90. Identification of development candidate 2-amino-4-{4-chloro-2-[2-(4-fluoro-1H-pyrazol-1-yl)ethoxy]-6-methylphenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide.
Zehnder, L., Bennett, M., Meng, J., Huang, B., Ninkovic, S., Wang, F., Braganza, J., Tatlock, J., Jewell, T., Zhou, J.Z., Burke, B., Wang, J., Maegley, K., Mehta, P.P., Yin, M.J., Gajiwala, K.S., Hickey, M.J., Yamazaki, S., Smith, E., Kang, P., Sistla, A., Dovalsantos, E., Gehring, M.R., Kania, R., Wythes, M., Kung, P.P.
J.Med.Chem.
HeaderChaperone/Chaperone Inhibitor
Released2011-03-17
Resolution2.000
CATH Insert Date08 May, 2011

PDB Images (5)

PDB Prints

PDB Chains (2)

Chain ID Date inserted into CATH CATH Status
A 09 May, 2011 Chopped
B 09 May, 2011 Chopped

CATH Domains (2)

Domain ID Date inserted into CATH Superfamily CATH Status
3r4nA00 30 Aug, 2013 3.30.565.10 Assigned
3r4nB00 30 Aug, 2013 3.30.565.10 Assigned

UniProtKB Entries (2)

Accession Gene ID Taxon Description
P07900 HS90A_HUMAN Homo sapiens Heat shock protein HSP 90-alpha
P07900 HS90A_HUMAN Homo sapiens Heat shock protein HSP 90-alpha