posted on 2012-07-09, 00:00authored byMatteo Calvaresi, Siegfried Höfinger, Francesco Zerbetto
Antifreeze proteins, AFP, impede freezing of bodily fluids
and
damaging of cellular tissues by low temperatures. Adsorption-inhibition
mechanisms have been developed to explain their functioning. Using
in silico Molecular Dynamics, we show that type I AFP can also induce
melting of the local ice surface. Simulations of antifreeze-positive
and antifreeze-negative mutants show a clear correlation between melting
induction and antifreeze activity. The presence of local melting adds
a function to type I AFPs that is unique to these proteins. It may
also explain some apparently conflicting experimental results where
binding to ice appears both quasipermanent and reversible.