Pleiades Publishing
Moscow University Chemistry Bulletin
,  volume 69 ,  issue 4 ,  pages 149-151

The photoreaction mechanism in the bacterial blue light receptor BLUF according to metadynamics modeling

Publication type: Journal Article
Publication date: 2014-07-01
Pleiades Publishing
scimago Q4
wos Q4
SJR: 0.153
CiteScore: 1.1
Impact factor: 0.5
ISSN: 00271314, 19350260
General Chemistry
Abstract
The mechanism of chemical transformations in the blue light photoreceptor domains (BLUF) implies the isomerization of the glutamine side chain. The Helmholtz energy profiles for the side-chain isomerization of the tautomeric form of glutamine in the BLUF domain of the bacterial protein AppA were calculated using metadynamics and the potentials that were obtained using quantum mechanics-molecular mechanics approximation (QM/MM).
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Khrenova M. G. et al. The photoreaction mechanism in the bacterial blue light receptor BLUF according to metadynamics modeling // Moscow University Chemistry Bulletin. 2014. Vol. 69. No. 4. pp. 149-151.
GOST all authors (up to 50) Copy
Khrenova M. G., Nikiforov A. A., Andrijchenko N. N., Mironov V., Nemukhin A. V. The photoreaction mechanism in the bacterial blue light receptor BLUF according to metadynamics modeling // Moscow University Chemistry Bulletin. 2014. Vol. 69. No. 4. pp. 149-151.
RIS |
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RIS Copy
TY - JOUR
DO - 10.3103/S0027131414040038
UR - https://doi.org/10.3103/S0027131414040038
TI - The photoreaction mechanism in the bacterial blue light receptor BLUF according to metadynamics modeling
T2 - Moscow University Chemistry Bulletin
AU - Khrenova, M. G.
AU - Nikiforov, A. A.
AU - Andrijchenko, N N
AU - Mironov, V.A.
AU - Nemukhin, A. V.
PY - 2014
DA - 2014/07/01
PB - Pleiades Publishing
SP - 149-151
IS - 4
VL - 69
SN - 0027-1314
SN - 1935-0260
ER -
BibTex |
Cite this
BibTex (up to 50 authors) Copy
@article{2014_Khrenova,
author = {M. G. Khrenova and A. A. Nikiforov and N N Andrijchenko and V.A. Mironov and A. V. Nemukhin},
title = {The photoreaction mechanism in the bacterial blue light receptor BLUF according to metadynamics modeling},
journal = {Moscow University Chemistry Bulletin},
year = {2014},
volume = {69},
publisher = {Pleiades Publishing},
month = {jul},
url = {https://doi.org/10.3103/S0027131414040038},
number = {4},
pages = {149--151},
doi = {10.3103/S0027131414040038}
}
MLA
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MLA Copy
Khrenova, M. G., et al. “The photoreaction mechanism in the bacterial blue light receptor BLUF according to metadynamics modeling.” Moscow University Chemistry Bulletin, vol. 69, no. 4, Jul. 2014, pp. 149-151. https://doi.org/10.3103/S0027131414040038.