Home / Publications / Molecular dynamics simulations of human kinase protein: the influence of a conserved glycine by serine substitution in the G-loop of a CDK2 active complex

Molecular dynamics simulations of human kinase protein: the influence of a conserved glycine by serine substitution in the G-loop of a CDK2 active complex

Dmitrii Alekseevich Kretov 1
Dmitrii Alekseevich Kretov
, 
Kholmirzo Tagoikulovich Kholmurodov 1, 2
Kholmirzo Tagoikulovich Kholmurodov
, 
Nataliya Alekseevna Koltovaya 2
Nataliya Alekseevna Koltovaya
10.1070/MC2006v016n04ABEH002337
Published 2006-09-01
Communication , Volume 16, Issue 4, 211-212
0
Share
Cite this
GOST
 | 
Cite this
GOST Copy
Kretov D. A., Kholmurodov K. T., Koltovaya N. A. Molecular dynamics simulations of human kinase protein: the influence of a conserved glycine by serine substitution in the G-loop of a CDK2 active complex // Mendeleev Communications. 2006. Vol. 16. No. 4. pp. 211-212.
GOST all authors (up to 50) Copy
Kretov D. A., Kholmurodov K. T., Koltovaya N. A. Molecular dynamics simulations of human kinase protein: the influence of a conserved glycine by serine substitution in the G-loop of a CDK2 active complex // Mendeleev Communications. 2006. Vol. 16. No. 4. pp. 211-212.
RIS
 | 
Cite this
RIS Copy
TY - JOUR
DO - 10.1070/MC2006v016n04ABEH002337
UR - https://mendcomm.colab.ws/publications/10.1070/MC2006v016n04ABEH002337
TI - Molecular dynamics simulations of human kinase protein: the influence of a conserved glycine by serine substitution in the G-loop of a CDK2 active complex
T2 - Mendeleev Communications
AU - Kretov, Dmitrii Alekseevich
AU - Kholmurodov, Kholmirzo Tagoikulovich
AU - Koltovaya, Nataliya Alekseevna
PY - 2006
DA - 2006/09/01
PB - Mendeleev Communications
SP - 211-212
IS - 4
VL - 16
ER -
BibTex
 | 
Cite this
BibTex (up to 50 authors) Copy
@article{2006_Kretov,
author = {Dmitrii Alekseevich Kretov and Kholmirzo Tagoikulovich Kholmurodov and Nataliya Alekseevna Koltovaya},
title = {Molecular dynamics simulations of human kinase protein: the influence of a conserved glycine by serine substitution in the G-loop of a CDK2 active complex},
journal = {Mendeleev Communications},
year = {2006},
volume = {16},
publisher = {Mendeleev Communications},
month = {Sep},
url = {https://mendcomm.colab.ws/publications/10.1070/MC2006v016n04ABEH002337},
number = {4},
pages = {211--212},
doi = {10.1070/MC2006v016n04ABEH002337}
}
MLA
Cite this
MLA Copy
Kretov, Dmitrii Alekseevich, et al. “Molecular dynamics simulations of human kinase protein: the influence of a conserved glycine by serine substitution in the G-loop of a CDK2 active complex.” Mendeleev Communications, vol. 16, no. 4, Sep. 2006, pp. 211-212. https://mendcomm.colab.ws/publications/10.1070/MC2006v016n04ABEH002337.

Abstract

We have performed the mutation analysis of functionally important structural elements for a cyclin dependent kinase protein via 2 ns molecular dynamics (MD) simulations of a crystal lattice of kinase active complex pT160-CDK2/cyclin A/ATP-Mg2+/substrate. Based on the MD simulation results we discuss the influence of the structural conformation changes on the kinase activity and molecular mechanism of regulation of phosphorylation.

References

1.
Crystal structure of cyclin-dependent kinase 2
De Bondt H.L., Rosenblatt J., Jancarik J., Jones H.D., Morgan D.O., Kim S.
Nature, 1993
3.
Dynamics of cAMP-Dependent Protein Kinase
Johnson D.A., Akamine P., Radzio-Andzelm E., Madhusudan, Taylor S.S.
Chemical Reviews, 2001
4.
The start geneCDC28 and the genetic stability of yeast
Devin A.B., Prosvirova T.Y., Peshekhonov V.T., Chepurnaya O.V., Smirnova M.E., Koltovaya N.A., Troitskaya E.N., Arman I.P.
Yeast, 1990
6.
10.1070/MC2006v016n04ABEH002337_bib6
Koltovaya
Yeast, 1995
7.
Mechanism of CDK activation revealed by the structure of a cyclinA-CDK2 complex
Jeffrey P.D., Russo A.A., Polyak K., Gibbs E., Hurwitz J., Massagué J., Pavletich N.P.
Nature, 1995