Počet záznamů: 1

Pathways and mechanisms for product release in the engineered haloalkane dehalogenases explored using classical and random acceleration molecular dynamics simulations

  1. 1.
    0331013 - UMCH-V 2010 RIV GB eng J - Článek v odborném periodiku
    Klvana, M. - Pavlová, M. - Koudeláková, T. - Chaloupková, R. - Dvořák, P. - Prokop, Z. - Stsiapanava, A. - Kutý, Michal - Kutá-Smatanová, Ivana - Dohnálek, Jan - Kulhánek, P. - Damborský, J.
    Pathways and mechanisms for product release in the engineered haloalkane dehalogenases explored using classical and random acceleration molecular dynamics simulations.
    Journal of Molecular Biology. Roč. 392, č. 5 (2009), s. 1339-1356 ISSN 0022-2836
    Grant CEP: GA MŠk(CZ) LC06010
    Výzkumný záměr: CEZ:AV0Z40500505; CEZ:AV0Z60870520
    Klíčová slova: haloalkane dehalogenase * product release * random acceleration molecular dynamics
    Kód oboru RIV: CD - Makromolekulární chemie
    Impakt faktor: 3.871, rok: 2009

    Eight mutants of the DhaA haloalkane dehalogenase carrying mutations at the residues lining two tunnels, previously observed by protein X-ray crystallography, were constructed and biochemically characterized. The mutants showed distinct catalytic efficiencies with the halogenated substrate 1,2,3-trichloropropane.
    Trvalý link: http://hdl.handle.net/11104/0176649