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GENERAL
TITLE
TARGETTING CONSERVED WATER MOLECULES: DESIGN OF 4-ARYL-5-CYANOPYRROLO [2,3-D] PYRIMIDINE HSP90 INHIBITORS USING FRAGMENT-BASED SCREENING AND STRUCTURE-BASED OPTIMIZATION
DATE LAST MODIFIED
7 Nov 2012
RELEASE
24 Oct 2012
OBSOLETE
CLASSIFICATION
CHAPERONE
EXPERIMENT TYPE
X-RAY DIFFRACTION
SPACE GROUP
P 21 21 2
RESOLUTION RANGE HIGH
2
RESOLUTION RANGE LOW
30
PUBMED ID
DOI
10.1016/J.BMC.2012.08.050
PDBe
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LIGANDS

Chains

Structure ChainTarget ProteinGeneExpression SystemOrganismSynonimsActions
P07900 HSP90AA1, HSP90A, HSPC1, HSPCA ESCHERICHIA COLI HUMAN
HEAT SHOCK 86 KDA, HSP 86, HSP86, RENAL CARCINOMA ...
Mutations
P07900 HSP90AA1, HSP90A, HSPC1, HSPCA ESCHERICHIA COLI HUMAN
HEAT SHOCK 86 KDA, HSP 86, HSP86, RENAL CARCINOMA ...
Mutations
NGL Viewer is used for the molecular visualization.
  • AS Rose, AR Bradley, Y Valasatava, JM Duarte, A Prlić and PW Rose. NGL viewer: web-based molecular graphics for large complexes. Bioinformatics: bty419, 2018. doi:10.1093/bioinformatics/bty419
  • AS Rose and PW Hildebrand. NGL Viewer: a web application for molecular visualization. Nucl Acids Res (1 July 2015) 43 (W1): W576-W579 first published online April 29, 2015. doi:10.1093/nar/gkv402