2020
DOI: 10.1016/j.jinorgbio.2019.110928
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Importance of the iron–sulfur component and of the siroheme modification in the resting state of sulfite reductase

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Cited by 6 publications
(17 citation statements)
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“…[29][30][31][32][33][34][35][36][37][38][39][40][41][42] We have, more in general, shown that even within the same class of compounds the performance of a functional can vary widely depending on the property sought, or on apparently simple changes in ligands (e.g., axial ligation in heme complexes). [43][44][45][46] The methodology employed here was selected for its ability to best mimic trends in UV-vis spectra as described in our previous study on hydroperoxocobalamin, thus also allowing consistency between the two sets of data. In terms of general structural features, the cobalamin-peroxo adducts (unlike, e.g., the case of Cbl(I)) offer no particular challenge -so that the choice of functional should affect the results at the level of detail (which, nevertheless, in predicting trends in UV-vis maxima of Cbl adducts, is essential).…”
Section: Methodsmentioning
confidence: 99%
See 1 more Smart Citation
“…[29][30][31][32][33][34][35][36][37][38][39][40][41][42] We have, more in general, shown that even within the same class of compounds the performance of a functional can vary widely depending on the property sought, or on apparently simple changes in ligands (e.g., axial ligation in heme complexes). [43][44][45][46] The methodology employed here was selected for its ability to best mimic trends in UV-vis spectra as described in our previous study on hydroperoxocobalamin, thus also allowing consistency between the two sets of data. In terms of general structural features, the cobalamin-peroxo adducts (unlike, e.g., the case of Cbl(I)) offer no particular challenge -so that the choice of functional should affect the results at the level of detail (which, nevertheless, in predicting trends in UV-vis maxima of Cbl adducts, is essential).…”
Section: Methodsmentioning
confidence: 99%
“…, axial ligation in heme complexes). 43–46 The methodology employed here was selected for its ability to best mimic trends in UV-vis spectra as described in our previous study on hydroperoxocobalamin, thus also allowing consistency between the two sets of data. In terms of general structural features, the cobalamin-peroxo adducts (unlike, e.g.…”
Section: Methodsmentioning
confidence: 99%
“…For SPLET, the phenolic compound first abandons a proton to form a phenoxy anion. Subsequently, an electron in PhO − transfers to the active radical, forming an anion that combined with H + to form RH to scavenge the free radical [37,38]. These mechanisms may occur in the antioxidant process, but different compounds have their own trends and reaction rates.…”
Section: Theoretical Mechanismmentioning
confidence: 99%
“… 2005 ). Sulfite reductase has two types of structures; α, β and γ heteromeric structure and α2β2 heterotetrameric structure (Brânzanic, Ryde and Silaghi-Dumitrescu 2020 ). The sulfite reductase complex of S. pombe is expected to be the α2β2 type.…”
Section: Sulfur Metabolism In S Pombementioning
confidence: 99%