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Figure 4 | BMC Bioinformatics

Figure 4

From: Modulation of p53 binding to MDM2: computational studies reveal important roles of Tyr100

Figure 4

(a),(b) Snapshot at the end of 20 ns simulation of Mc3AT1. Y100 stays in a 'flipped-in' conformation and L26 of p53 (red) is out of the binding pocket, F19 and W23 fits into their crystallographically observed position and W23 and L54 forms HB; (c),(d) Snapshots at the end of 20 ns simulation of Mc3AT2. F19, W23 and L26 are fitted into the binding pocket of MDM2. Critical H-bond between W23 and L54 is marked with dashed line. Figures in the same row represent the same structure but differ in ribbon and surface representations of MDM2 (green).

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