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Biological and Medicinal Chemistry

Working Paper

Capture of activated dioxygen intermediates at the copper-active site of a lytic polysaccharide monooxygenase

Gabriela C. Schröder, William B. O'Dell, Simon P. Webb, Pratul K. Agarwal, Flora Meilleur

Version 1 posted 13 December 2021

631

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Catalysis

Working Paper

In Crystallo Reactions with an Engineered Cytochrome P450 Peroxygenase

Joel Lee, John Bruning, Stephen Bell

Version 1 posted 17 August 2023

194

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Biological and Medicinal Chemistry

Working Paper

[FeFe]-Hydrogenase Maturation: H-Cluster Assembly Intermediates Tracked by Electron Paramagnetic Resonance, Infrared, and X-Ray Absorption Spectroscopy

Brigitta Németh, Moritz Senger, Holly J. Redman, Pierre Ceccaldi, Joan Broderick, Ann Magnuson, Sven T. Stripp, Michael Haumann, Gustav Berggren

Version 1 posted 22 April 2020

381

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Biological and Medicinal Chemistry

Working Paper

The Geometry of the Catalytic Active Site in [FeFe]-Hydrogenases is Determined by Hydrogen Bonding and Proton Transfer

Jifu Duan, Stefan Mebs, Moritz Senger, Konstantin Laun, Florian Wittkamp, Joachim Heberle, Thomas Happe, Eckhard Hofmann, Ulf-Peter Apfel, Martin Winkler, Michael Haumann, Sven T. Stripp

Version 1 posted 22 February 2019

568

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Catalysis

Working Paper

Influence of the Greater Protein Environment on the Electrostatic Potential in Metalloenzyme Active Sites: the Case of Formate Dehydrogenase

Azadeh Nazemi, Adam Steeves, Heather Kulik

Version 1 posted 27 December 2021

305

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2

Citations

Theoretical and Computational Chemistry

Working Paper

Benchmarking Density Functional Theory Methods for Metalloenzyme Reactions: The Introduction of the MME55 Set

Dominique Wappett, Lars Goerigk

Version 2 posted 25 September 2023

491

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Inorganic Chemistry

Working Paper

Strongly Coupled Redox-Linked Conformational Switching at the Active Site of the Non-Heme Iron-Dependent Dioxygenase, TauD

Christopher John, Greg M. Swain, Robert P. Hausinger, Denis A. Proshlyakov

Version 1 posted 12 August 2019

527

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Theoretical and Computational Chemistry

Working Paper

Revealing Quantum Mechanical Effects in Enzyme Catalysis with Large-Scale Electronic Structure Simulation

Zhongyue Yang, Rimsha Mehmood, Mengyi Wang, Helena W. Qi, Adam H. Steeves, Heather Kulik

Version 1 posted 26 September 2018

530

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Inorganic Chemistry

Working Paper

Following Electroenzymatic Hydrogen Production by Rotating Ring Disk Electrochemistry and Mass Spectrometry

Jaloliddin Khushvakov, Robin Nussbaum, Cécile Cadoux, Jifu Duan, Sven T. Stripp, Ross Milton

Version 1 posted 19 January 2021

373

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Catalysis

Working Paper

Role of metal coordinated auxiliary residues in catalysis: A structural and mechanistic study.

Amith Kamble, Dhruv Pahwa, Pravindra kumar

Version 1 posted 09 September 2024

87

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Refine Search

11 results in metalloenzymes in Keywords: metalloenzymes

Capture of activated dioxygen intermediates at the copper-active site of a lytic polysaccharide monooxygenase

In Crystallo Reactions with an Engineered Cytochrome P450 Peroxygenase

[FeFe]-Hydrogenase Maturation: H-Cluster Assembly Intermediates Tracked by Electron Paramagnetic Resonance, Infrared, and X-Ray Absorption Spectroscopy

The Geometry of the Catalytic Active Site in [FeFe]-Hydrogenases is Determined by Hydrogen Bonding and Proton Transfer

Influence of the Greater Protein Environment on the Electrostatic Potential in Metalloenzyme Active Sites: the Case of Formate Dehydrogenase

Benchmarking Density Functional Theory Methods for Metalloenzyme Reactions: The Introduction of the MME55 Set

Strongly Coupled Redox-Linked Conformational Switching at the Active Site of the Non-Heme Iron-Dependent Dioxygenase, TauD

Revealing Quantum Mechanical Effects in Enzyme Catalysis with Large-Scale Electronic Structure Simulation

Following Electroenzymatic Hydrogen Production by Rotating Ring Disk Electrochemistry and Mass Spectrometry

Role of metal coordinated auxiliary residues in catalysis: A structural and mechanistic study.

11 results in Keywords: metalloenzymes