Keywords
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Parkinson's Disease, α-synuclein, Curcumin, Lewy Bodies, M.D simulation
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Abstract
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Parkinson disease (PD), a chronic progressive neuro-degenerative disorder predominantly
affecting elderlypeople, is mainly characterized by resting tremor, rigidity, bradykinesia, postural
instability and gait disorder [1]. The presence of Lewy bodies (LB) and Lewy neurites (LN),
proteinaceous inclusions whose main constituent is fibrillary-aggregated α-synuclein, is a
defining neuropathological alteration observed in the brain of affected patients [2].
Recently, novel therapies involving natural antioxidants and plant-derived molecules like
curcumin with neuroprotective properties are being exploited for adjunctive therapy. Curcumin
exhibits antioxi- dant, anti-inflammatory and anti-cancer properties, crosses the blood-brain
barrier and is neuroprotective in neurological disorders [3].
We examined the ability of curcumin to probable prevention of protein aggregation leading to
PD by molecular dynamics simulation (MD). The results of the simulation studies were
presented as structural data like hydrogen bonding, interacting residues and various distribution
functions as well as energetics of the considered system. The interaction energies, and the
contribution of lennard-Jones and electrostatic interactions in intarction energy have been also
analysed. Collectively; our results suggest that curcumin and probably polyphenolic compounds
derived from curcumine can be pursued as potential therapeutic agents for prevention and
treatment of PD and similar neurological diseases.
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