Potential Coupling of Chemical and Conformational Changes in Pyruvate Formate-Lyase During the Catalysis (CROSBI ID 605831)
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Podaci o odgovornosti
Čondić-Jurkić, Karmen ; Smith, Ana-Sunčana ; Smith, David M.
engleski
Potential Coupling of Chemical and Conformational Changes in Pyruvate Formate-Lyase During the Catalysis
Pyruvate formate lyase is a radical enzyme that catalyzes a two-substrate reaction involving pyruvate and CoA. In this computational study, it was investigated is it possible that the chemical reaction with pyruvate in the active site serves as a trigger for the required conformational changes of PFL to allow approach of the second substrate, CoA, to the reaction center.
pyruvate formate lyase; catalysis; molecular dynamics; free energy
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Podaci o prilogu
2013.
objavljeno
Podaci o matičnoj publikaciji
Podaci o skupu
Summer School "Fundamental Problems in Statistical Physics"
poster
16.06.2013-29.06.2013
Leuven, Belgija