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• W2051240221 abstract "What is the identity of the metal ion in the active sites of diol dehydratase? To address this question, we calculated the M-O bond lengths in the active sites using QM/MM calculations (M=K, Na, Mg, Ca). Our results show that the previous assignment of the metal ion in the substrate-binding site is wrong and that the identity of the metal ion is likely to be Ca2+. This is consistent with accumulated experimental evidence." @default.
• W2051240221 created "2016-06-24" @default.
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• W2051240221 date "2009-04-01" @default.
• W2051240221 modified "2023-10-18" @default.
• W2051240221 title "What is the Identity of the Metal Ions in the Active Sites of Coenzyme B₁₂-Dependent Diol Dehydratase? A Computational Mutation Analysis" @default.
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• W2051240221 doi "https://doi.org/10.1021/jp9001737" @default.
• W2051240221 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/19338314" @default.
• W2051240221 hasPublicationYear "2009" @default.
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