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. 2024 Aug 21;481(16):1075–1096. doi: 10.1042/BCJ20240110

Figure 10. Predicted binding modes of compound 4 in the X-ray crystal structure of TgDXR.

Figure 10.

(A) The fosmidomycin binding site is illustrated, with fosmidomycin represented as yellow sticks, interacting with Glu231, Asn298, and His280. (B) Docking results for compound 4 reveal that the 3,4-dichlorophenyl substituent binds in a previously unoccupied pocket.