Examination of iron-sulfur clusters in proteins

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Gruszecki, Elijah, Michael
Issue Date
2024-05
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Electronic thesis
Thesis
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en_US
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Chemistry
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Solar energy utilization is one of the most viable avenues of alternative energy productiondue to efficiency and abundance of the resources. While we can generate electrical energy using solar photovoltaics, the production of chemicals and fuels using solar energy, water, and carbon feed stocks is a highly attractive solution. The conversion of solar energy to chemical energy in a highly efficient manner is performed by photosynthesis. Thus, nature provides a blueprint for the design of a new generation of devices for the production of solar chemicals and fuels. The goal of this thesis research was to better understand the tuning of charge transfer cofactors in natural photosynthesis. There are two types of photosynthetic reaction centers in nature, Type I (with iron-sulfur clusters serving as the terminal electron acceptors) and Type II (with quinone molecules acting as the terminal electron acceptors). The Type I photosynthetic reaction center, Photosystem I (PSI), in higher plants and cyanobacteria, contains three four iron-four sulfur [4Fe-4S] clusters as charge carriers which play a crucial role in the efficient electron transfer. In this thesis, I am examining the electronic structure of iron-sulfur clusters in model proteins and a [4Fe-4S] cluster of PSI using density functional theory (DFT) methods.
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May2024
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Rensselaer Polytechnic Institute, Troy, NY
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