A molecular model and Monte Carlo simulation of flavivirus envelope building block
Copyright policy )A molecular model and Monte Carlo simulation of flavivirus envelope building block
A molecular model of mature dengue virus envelope building block consisting of two E and two M protein subunits is constructed. Monte Carlo optimisation is performed for the model in the implicit membrane system. Interactions between the ectodomains and membrane parts of E and M proteins are studied, and possible role of conserved residues is suggested. The opening of E protein detergent binding site and its fixation in the open state by the M non-structured loop is observed.
- Moscow Institute of Physics and Technology Russian Federation
- Lomonosov Moscow State University Russian Federation
- Chumakov Institute of Poliomyelitis and Viral Encephalitides Russian Federation
Models, Molecular, Viral Envelope Proteins, Computer Simulation, Dengue Virus, Crystallography, X-Ray, Monte Carlo Method, Protein Structure, Tertiary
Models, Molecular, Viral Envelope Proteins, Computer Simulation, Dengue Virus, Crystallography, X-Ray, Monte Carlo Method, Protein Structure, Tertiary
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