Molecular Dynamics of Serine Hydrolases
The serine hydrolase family contains many pharmacologically important enzymes and drug targets. In our research, we use this protein family to investigate fundamental aspects of molecular recognition, mechanism of catalysis/inhibition and rational drug design. In this proposal we would like to investigate the molecular dynamics of two serine hydrolases (phospholipase A2 and bacterial serine hydrolase SsEM28) in the presence or absence of ligands (inhibitors). This study is a follow up on a study initiated 2013 on the serine hydrolase acetylcholinesterase (ILL exp. report 8-04-708). The results obtained by neutron scattering will be related to data from other computational and experimental techniques applied by us to this particular system.
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Download DataThe recommended format for citing this dataset in a research publication is in the following format:
LINUSSON Anna; ANDERSSON David; EKSTROM FREDERIK; Bernhard Frick; HOLMGREN Stina; KOZA Michael Marek; MARTINEZ Nicolas; PETERS Judith; SEYDEL Tilo and TROVASLET Marie. (2014). Molecular Dynamics of Serine Hydrolases. Institut Laue-Langevin (ILL) doi:10.5291/ILL-DATA.8-04-728
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