Article
ZZ made EZ: influence of inhibitor configuration on enzyme selectivity.
Journal of molecular biology - 18 Jul 2003
Rauh Daniel, Klebe Gerhard, Stürzebecher Jörg, Stubbs Milton T
Abstract excerpt
Selectivity of drug targeting is necessary in order to forestall undesired side-effects. Here, we examine the structural grounds for the configuration-dependent selectivity of 2,7-bis(4-amidinobenzylidene)-cycloheptan-1-one (1) for factor Xa and trypsin: Previous studies showed that factor Xa is preferentially inhibited by the (Z,Z) configuration isomer of (1), whilst trypsin binds equally well to both (E,Z) and...
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