Molecular Dynamic simulation.

<p>A) Snapshots at 20, 30, 40, and 50 ns of the protein structures during the simulation. The proteins are superimposed to each other, WT-g14-3-3 is in green and Pho-g14-3-3 is in violet. B) Magnification of the loop between helices H and I. The phosphorylated Thr214 and the surrounding polar residues are represented in sticks colored by atom. C) Superimposition Pho-g14-3-3 at 20 ns of MD (violet), WT-g14-3-3 (green) and h14-3-3ε (grey) in complex with phosphopeptide (represented as sticks in pink-blue) showing that upon phosphorylation g14-3-3 helix I repositions closest to helix H but still doesn't overlap with h14-3-3ε helix I. The h14-3-3ε residues involved in the interaction with the peptide are represented as stick (grey).