How does mutation located far from both binding sites and active residue affect to enzyme? Investigation of vitamin K epoxide reductase by docking simulation and molecular dynamics

Kazuki Takeda; Yoshinori Ikenaka; Denis Fourches; Kazuyuki D. Tanaka; Shouta M.M. Nakayama; Tsutomu Tanikawa; Dhoha Triki; Xinhao Li; Mayumi Ishizuka

[4P-0564] How does mutation located far from both binding sites and active residue affect to enzyme? Investigation of vitamin K epoxide reductase by docking simulation and molecular dynamics

〇Kazuki Takeda¹, Yoshinori Ikenaka^1,2, Denis Fourches³, Kazuyuki D. Tanaka⁴, Shouta M.M. Nakayama¹, Tsutomu Tanikawa⁴, Dhoha Triki³, Xinhao Li³, Mayumi Ishizuka¹ (1.Lab. of Tox., Grad. Sch. of Vet. Med., Univ. of Hokkaido, 2.Water. Res. Gr.Unit for Env. Sci. & Manag., North-West Univ., 3.Dept. of Chem., NC St. Univ., 4.Tech. Lab., Ikari Shodoku CO. Ltd.)

VitaminK, Mutation, MolecularDynamics, Rodent, DrugResistance

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The 42nd Annual Meeting of the Molecular Biology Society of Japan

[4P-0564] How does mutation located far from both binding sites and active residue affect to enzyme? Investigation of vitamin K epoxide reductase by docking simulation and molecular dynamics

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