Figure 4 | Scientific Reports

Figure 4

From: Different Behaviors of a Substrate in P450 Decarboxylase and Hydroxylase Reveal Reactivity-Enabling Actors

Figure 4

Substrate dynamics in the intermediate state: (Left) Trends for the Root Mean Square Deviations of the substrate center of mass over the 150 ns simulation trajectory. The darker lines depict the moving average for the RMSD value while the light regions indicate instantaneous values. (Right) Comparison of the flexibility of substrate oxygen and carbon atoms- C1 indicates the carboxylate Carbon and C14 the terminal carbon on the substrate tail. Values for P450BSβ are indicated in red and for OleTJE in black.

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