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Article

Correlation between rate of enzyme-substrate diffusional encounter and average Boltzmann factor around active site.

Biopolymers - 1 Apr 1998

Zhou H X, Briggs J M, Tara S, McCammon J A

Abstract excerpt

The utility of the average Boltzmann factor around the active site of an enzyme as the predictor of the electrostatic enhancement of the substrate binding rate is tested on a set of data on wild-type acetylcholinesterase and 18 charge mutants recently obtained by Brownian dynamics simulations. A good correlation between the average Boltzmann factors and the substrate binding rate constants is found. The effects...

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Identifiers

PMID: 9530014
DOI: 10.1002/(SICI)1097-0282(19980415)45:5<355::AID-BIP4>3.0.CO;2-K

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PubMed metadata and Literature Corpus relationships. Corpus snapshot updated 7 Sept 2026. Manifest publication-graph-cohort-2026-09-08.1.

Source receipt: pubmed, retrieved 7 Sept 2026.

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