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Docking poses of two newly discovered substrates. (a) Compound 82, shown in green sticks is docked in the outward-open conformation (beige). (b) Compound 59, shown in cyan sticks, is docked in the outward-occluded conformation (light blue). While both compounds occupy PA, as predicted, compound 82 establishes additional hydrogen bonds with Glu136 and Ser342.
