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. 2021 Dec 26;27(1):119. doi: 10.3390/molecules27010119

Figure 2.

Figure 2

PETase backbone structure is superimposed with different solvents. The wild-type crystal structure is in blue. MD simulation for 150 ns with water as a solvent is in red. Simulation with [Ch]3[PO4], [C4MIM][Ac] and [C2MIM][Ac] is represented in yellow, green, and light blue, respectively.