Issue 47, 2022

Simulation design of a binding-pocket structure of natural enzymes in MOFs for enhanced catalytic activity

Abstract

We demonstrated that the activity gap between metal–organic frameworks (Fe) and horseradish peroxidase could be bridged by simulating the binding-pocket structure and adding active centers. This customized structure promoted the activation and enrichment of substrates, and addition of gold nanoparticles led to activity superposition and synergistic enhancement.

Graphical abstract: Simulation design of a binding-pocket structure of natural enzymes in MOFs for enhanced catalytic activity

Supplementary files

Article information

Article type
Communication
Submitted
22 Mar 2022
Accepted
10 May 2022
First published
11 May 2022

Chem. Commun., 2022,58, 6745-6748

Simulation design of a binding-pocket structure of natural enzymes in MOFs for enhanced catalytic activity

W. Zhu, C. Chen, Z. Wen, L. Ding, J. Wei, J. Qian, N. Hao and K. Wang, Chem. Commun., 2022, 58, 6745 DOI: 10.1039/D2CC01634F

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