Chlorination versus hydroxylation selectivity mediated by the non-heme iron halogenase WelO5-Reference-Cited by-同舟云学术

Chlorination versus hydroxylation selectivity mediated by the non-heme iron halogenase WelO5

Published:2020 Issue:16 Volume:22 Page:8699-8712
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Zhang Xuan¹²³⁴⁵,Wang Zikuan¹²³⁴⁵,Gao Jun⁶⁷⁸⁹⁵^ORCID,Liu Wenjian¹⁰¹¹¹²⁵

Affiliation:

1. Beijing National Center for Molecular Sciences

2. College of Chemistry and Molecular Engineering

3. Peking University

4. Beijing 100871

5. P. R. China

6. Hubei Key Laboratory of Agricultural Bioinformatics

7. College of Informatics

8. Huazhong Agricultural University

9. Wuhan

10. Qingdao Institute for Theoretical and Computational Sciences

11. Shandong University

12. Qingdao 266237

Abstract

O₂ activation in WelO5 (an α-KG dependent halogenase) leads to a Fe(IV)O species with an equatorial conformation. After hydrogen abstraction, the hydroxyl ligand is far from the substrate radical which leads to the chlorination selectivity

Funder

National Natural Science Foundation of China

National Basic Research Program of China

Fundamental Research Funds for the Central Universities

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2020/CP/D0CP00791A

Reference71 articles.

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5. Trends in Substrate Hydroxylation Reactions by Heme and Nonheme Iron(IV)-Oxo Oxidants Give Correlations between Intrinsic Properties of the Oxidant with Barrier Height

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