Berti Lab

    Overview

    DNA repair

    Antibiotic Targets

    KIEs by NMR

    Training

 


Research

 Overview
 DNA Repair Enzymes
 Antibiotic Targets: AroA & MurA
 KIEs by NMR
 Training

Inhibitor Design

 

Immucilin-H (experimental drug BCX-1777) is a TS analogue that is an inhibitor of purine nucleoside phosphorylase (PNP).

Changes in the charge distribution from the substrate inosine (bottom left) to the TS (middle) are shown on the space-filling models (blue - positive; green - neutral, red - negative).

Immucilin-H (right) was designed to mimic the geometry and charge of the TS. It binds to the enzyme 350,000-fold more tightly than inosine. (Miles et al. (1998) Biochemistry 37, 8615-8621).