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Article

Contribution of Electrostatics to the Kinetics of Electron Transfer from NADH-Cytochrome b5 Reductase to Fe(III)-Cytochrome b5.

The journal of physical chemistry. B - 25 Aug 2016

Kollipara Sireesha, Tatireddy Shivakishore, Pathirathne Thusitha, Rathnayake Lasantha K, Northrup Scott H

Abstract excerpt

Brownian dynamics (BD) simulations provide here a theoretical atomic-level treatment of the reduction of human ferric cytochrome b5 (cyt b5) by NADH-cytochrome b5 reductaste (cyt b5r) and several of its mutants. BD is used to calculate the second-order rate constant of electron transfer (ET) between the proteins for direct correlation with experiments. Interestingly, the inclusion of electrostatic forces...

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Identifiers

PMID: 27059440
DOI: 10.1021/acs.jpcb.6b01726

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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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