Russian Chemical Bulletin

, том 65 , издание 6 , страницы 1592-1607

Molecular polymorphism of human enzymes as the basis of individual sensitivity to drugs. Supercomputer-assisted modeling as a tool for analysis of structural changes and enzymatic activity of proteins

Тип публикации: Journal Article

Дата публикации: 2016-06-01

Springer Nature

Russian Chemical Bulletin

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ISSN: 10665285, 15739171

DOI: 10.1007/s11172-016-1487-8

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General Chemistry

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The nature of individual sensitivity to drugs associated with molecular polymorphism of human enzymes is discussed. The influence of molecular polymorphism on the activity of key human esterases, in particular, cholinesterases and carboxylesterase, responsible for hydrolytic metabolism of ester-containing drugs, is analyzed. A method was developed, which involves supercomputer-assisted modeling as a tool for assessment of molecular mechanism of the impact of point mutations on the catalytic activity of enzymes. This work is a part of a study aimed at elaboration of the concept and methods of personalized medicine.

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Щегольков Евгений

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Институт органического синтеза им. И.Я. Постовского УрО РАН

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Органический синтез

1 цитирование

Зверева Мария

д.х.н., проф.

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Московский государственный университет имени М.В. Ломоносова

1 цитирование

Ле-Дейген Ирина

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к.х.н.

68 публикаций, 2 818 цитирований, 8 рецензий

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Московский государственный университет имени М.В. Ломоносова

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Полимеры для доставки лекарств

Системы доставки лекарственных веществ

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Захарова Люция

д.х.н., проф.

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Институт органической и физической химии им. А.Е. Арбузова КазНЦ РАН

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Varfolomeev S. D. et al. Molecular polymorphism of human enzymes as the basis of individual sensitivity to drugs. Supercomputer-assisted modeling as a tool for analysis of structural changes and enzymatic activity of proteins // Russian Chemical Bulletin. 2016. Vol. 65. No. 6. pp. 1592-1607.

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Varfolomeev S. D., Lushchekina S. V., Nemukhin A. V., Kulakova A. M., Kots E. D., Makhaeva G. F., Delacour H., Lockridge O., MASSON P. Molecular polymorphism of human enzymes as the basis of individual sensitivity to drugs. Supercomputer-assisted modeling as a tool for analysis of structural changes and enzymatic activity of proteins // Russian Chemical Bulletin. 2016. Vol. 65. No. 6. pp. 1592-1607.

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TY - JOUR

DO - 10.1007/s11172-016-1487-8

UR - https://doi.org/10.1007/s11172-016-1487-8

TI - Molecular polymorphism of human enzymes as the basis of individual sensitivity to drugs. Supercomputer-assisted modeling as a tool for analysis of structural changes and enzymatic activity of proteins

T2 - Russian Chemical Bulletin

AU - Varfolomeev, S. D.

AU - Lushchekina, S V

AU - Nemukhin, A. V.

AU - Kulakova, A M

AU - Kots, E D

AU - Makhaeva, G. F.

AU - Delacour, H.

AU - Lockridge, O

AU - MASSON, P.

PY - 2016

DA - 2016/06/01

PB - Springer Nature

SP - 1592-1607

IS - 6

VL - 65

SN - 1066-5285

SN - 1573-9171

ER -

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@article{2016_Varfolomeev,

author = {S. D. Varfolomeev and S V Lushchekina and A. V. Nemukhin and A M Kulakova and E D Kots and G. F. Makhaeva and H. Delacour and O Lockridge and P. MASSON},

title = {Molecular polymorphism of human enzymes as the basis of individual sensitivity to drugs. Supercomputer-assisted modeling as a tool for analysis of structural changes and enzymatic activity of proteins},

journal = {Russian Chemical Bulletin},

year = {2016},

volume = {65},

publisher = {Springer Nature},

month = {jun},

url = {https://doi.org/10.1007/s11172-016-1487-8},

number = {6},

pages = {1592--1607},

doi = {10.1007/s11172-016-1487-8}

}

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Varfolomeev, S. D., et al. “Molecular polymorphism of human enzymes as the basis of individual sensitivity to drugs. Supercomputer-assisted modeling as a tool for analysis of structural changes and enzymatic activity of proteins.” Russian Chemical Bulletin, vol. 65, no. 6, Jun. 2016, pp. 1592-1607. https://doi.org/10.1007/s11172-016-1487-8.