Mendeleev Communications
,  том 28 ,  издание 2 ,  страницы 170-172

DFT modeling of the first step of plastoquinol oxidation by the iron–sulfur protein of the cytochrome b6f complex

Тип публикации: Journal Article
Дата публикации: 2018-03-22
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wos Q3
БС1
SJR: 0.305
CiteScore: 3.0
Impact factor: 1.7
ISSN: 09599436, 1364551X
General Chemistry
Краткое описание
DFT analysis of several models for 2,3,5-trimethylbenzoquinol oxidation in the catalytic center of the cytochrome b6 f complex, consisting of the [Fe2S2] cluster and its surroundings, has been performed. The comparison of optimized structures with different numbers (14–20) of fixed internal coordinates allowed us to find an optimal model close to the crystal structure.
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Ustynyuk L. Y. et al. DFT modeling of the first step of plastoquinol oxidation by the iron–sulfur protein of the cytochrome b6f complex // Mendeleev Communications. 2018. Vol. 28. No. 2. pp. 170-172.
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Ustynyuk L. Y., Trubitsin B. V., Tikhonov A. N. DFT modeling of the first step of plastoquinol oxidation by the iron–sulfur protein of the cytochrome b6f complex // Mendeleev Communications. 2018. Vol. 28. No. 2. pp. 170-172.
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TY - JOUR
DO - 10.1016/j.mencom.2018.03.020
UR - https://linkinghub.elsevier.com/retrieve/pii/S0959943618300695
TI - DFT modeling of the first step of plastoquinol oxidation by the iron–sulfur protein of the cytochrome b6f complex
T2 - Mendeleev Communications
AU - Ustynyuk, Leila Yu.
AU - Trubitsin, Boris V.
AU - Tikhonov, Alexander N.
PY - 2018
DA - 2018/03/22
PB - OOO Zhurnal "Mendeleevskie Soobshcheniya"
SP - 170-172
IS - 2
VL - 28
SN - 0959-9436
SN - 1364-551X
ER -
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@article{2018_Ustynyuk,
author = {Leila Yu. Ustynyuk and Boris V. Trubitsin and Alexander N. Tikhonov},
title = {DFT modeling of the first step of plastoquinol oxidation by the iron–sulfur protein of the cytochrome b6f complex},
journal = {Mendeleev Communications},
year = {2018},
volume = {28},
publisher = {OOO Zhurnal "Mendeleevskie Soobshcheniya"},
month = {mar},
url = {https://linkinghub.elsevier.com/retrieve/pii/S0959943618300695},
number = {2},
pages = {170--172},
doi = {10.1016/j.mencom.2018.03.020}
}
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Ustynyuk, Leila Yu., et al. “DFT modeling of the first step of plastoquinol oxidation by the iron–sulfur protein of the cytochrome b6f complex.” Mendeleev Communications, vol. 28, no. 2, Mar. 2018, pp. 170-172. https://linkinghub.elsevier.com/retrieve/pii/S0959943618300695.