Protonation of bridging sulfur in cubanoid Fe4S4clusters causes large geometric changes: the theory of geometric and electronic structure.

Ian Dance

Dalton Trans., 2015, 44, 4707
DOI: 10.1039/C4DT03681F

Redox-dependent conformational changes of a proximal [4Fe–4S] cluster in Hyb-type [NiFe]-hydrogenase to protect the active site from O2

Noor Dina Muhd Noor, Hiroaki Matsuura, Koji Nishikawa, Hulin Tai, Shun Hirota, Jaehyun Kim, Jiyoung Kang, Masaru Tateno, Ki-Seok Yoon, Seiji Ogo, Shintaro Kubota, Yasuhito Shomura and Yoshiki Higuchi

Chem. Commun., 2018, 54, 12385
DOI: 10.1039/C8CC06261G

Misconception of reductive elimination of H2, in the context of the mechanism of nitrogenase

Ian Dance

Dalton Trans., 2015, 44, 9027
DOI: 10.1039/C5DT00771B

New insights into the oxidation process from neutron and X-ray crystal structures of an O2-sensitive [NiFe]-hydrogenase

Takeshi Hiromoto, Koji Nishikawa, Seiya Inoue, Hideaki Ogata, Yuta Hori, Katsuhiro Kusaka, Yu Hirano, Kazuo Kurihara, Yasuteru Shigeta, Taro Tamada and Yoshiki Higuchi

Chem. Sci., 2023, 14, 9306
DOI: 10.1039/D3SC02156D

Re-engineering a NiFe hydrogenase to increase the H2production bias while maintaining native levels of O2tolerance

Lindsey A. Flanagan, John J. Wright, Maxie M. Roessler, James W. Moir and Alison Parkin

Chem. Commun., 2016, 52, 9133
DOI: 10.1039/C6CC00515B

Survey of the Geometric and Electronic Structures of the Key Hydrogenated Forms of FeMo-co, the Active Site of the Enzyme Nitrogenase: Principles of the Mechanistically Significant Coordination Chemistry

Ian Dance

Inorganics, 2019, 7, 8
DOI: 10.3390/inorganics7010008

Second and Outer Coordination Sphere Effects in Nitrogenase, Hydrogenase, Formate Dehydrogenase, and CO Dehydrogenase

Sven T. Stripp, Benjamin R. Duffus, Vincent Fourmond, Christophe Léger, Silke Leimkühler, Shun Hirota, Yilin Hu, Andrew Jasniewski, Hideaki Ogata and Markus W. Ribbe

Chem. Rev., 2022, 122, 11900
DOI: 10.1021/acs.chemrev.1c00914

Unusual structures and unknown roles of FeS clusters in metalloenzymes seen from a resonance Raman spectroscopic perspective

Giorgio Caserta, Lidia Zuccarello, Catarina Barbosa, Célia M. Silveira, Elin Moe, Sagie Katz, Peter Hildebrandt, Ingo Zebger and Smilja Todorovic

Coordination Chemistry Reviews, 2022, 452, 214287
DOI: 10.1016/j.ccr.2021.214287

Conserved Histidine Adjacent to the Proximal Cluster Tunes the Anaerobic Reductive Activation of Escherichia coli Membrane‐Bound [NiFe] Hydrogenase‐1

Lindsey A. Flanagan, Harriet S. Chidwick, Julia Walton, James W. B. Moir and Alison Parkin

ChemElectroChem, 2018, 5, 855
DOI: 10.1002/celc.201800047

Structural Basis of the Function of [NiFe]-hydrogenases

Koji Nishikawa, Hideaki Ogata and Yoshiki Higuchi

Chem. Lett., 2020, 49, 164
DOI: 10.1246/cl.190814

Ab Initio Electronic Structure Calculation of [4Fe-3S] Cluster of Hydrogenase as Dihydrogen Dissociation/Production Catalyst

Jaehyun Kim, Jiyoung Kang, Hiroshi Nishigami, Hiori Kino and Masaru Tateno

J. Phys. Soc. Jpn., 2018, 87, 034804
DOI: 10.7566/JPSJ.87.034804

Structure and function of [NiFe] hydrogenases

Hideaki Ogata, Wolfgang Lubitz and Yoshiki Higuchi

J Biochem, 2016, 160, 251
DOI: 10.1093/jb/mvw048

Tracking the route of molecular oxygen in O 2 -tolerant membrane-bound [NiFe] hydrogenase

Jacqueline Kalms, Andrea Schmidt, Stefan Frielingsdorf, Tillmann Utesch, Guillaume Gotthard, David von Stetten, Peter van der Linden, Antoine Royant, Maria Andrea Mroginski, Philippe Carpentier, Oliver Lenz and Patrick Scheerer

Proc. Natl. Acad. Sci. U.S.A., 2018, 115
DOI: 10.1073/pnas.1712267115

Electrochemical insights into the mechanism of NiFe membrane-bound hydrogenases

Lindsey A. Flanagan and Alison Parkin

Biochemical Society Transactions, 2016, 44, 315
DOI: 10.1042/BST20150201

Structure and electrochemistry of proteins harboring iron-sulfur clusters of different nuclearities. Part IV. Canonical, non-canonical and hybrid iron-sulfur proteins

Piero Zanello

Journal of Structural Biology, 2019, 205, 103
DOI: 10.1016/j.jsb.2019.01.003

Proton Transfer Pathways between Active Sites and Proximal Clusters in the Membrane-Bound [NiFe] Hydrogenase

Daria Tombolelli and Maria Andrea Mroginski

J. Phys. Chem. B, 2019, 123, 3409
DOI: 10.1021/acs.jpcb.9b00617

What is the role of the isolated small water pool near FeMo‐co, the active site of nitrogenase?

Ian Dance

The FEBS Journal, 2018, 285, 2972
DOI: 10.1111/febs.14519

Theoretical Analysis of the Dynamical Effects of the Amino Acid Residue Replacement in the Vicinity of the [4Fe–4S] Proximal Cluster on the O2-Tolerance of [NiFe]-Hydrogenases

Ryu-ichiro Terada, Jiyoung Kang and Masaru Tateno

J. Phys. Soc. Jpn., 2021, 90, 034804
DOI: 10.7566/JPSJ.90.034804