Figure 4
From: Adaptive simulations, towards interactive protein-ligand modeling
PR binding mechanism. Two different views of the ligand entrance and the plasticity upon progesterone binding in PR. (a) Different ligand snapshots along the binding with two protein structures highlighting the initial closed (red cartoon) and intermediate open states (white cartoon). (b) A closer zoom at the entrance region with the ligand shown in the native bound structure; same color-coding as in the (a) panel but for the ligand (shown with atom element colors).
