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. Author manuscript; available in PMC: 2018 Jun 15.
Published in final edited form as: Bioorg Med Chem. 2017 Apr 8;25(12):3223–3234. doi: 10.1016/j.bmc.2017.04.008

Fig. 6.

Fig. 6

Left, Docking of RS-IDHP dimer 4c Isoxaquidar (carbons green, nitrogens blue, and oxygens red) at the human ABCB10 transporter (blue). The dimer 4c spans the interface between the NBDs. Top right. Close up view of dimer 4c interacting with the left NBD, The isoxazole moiety locks Ile578 by interacting with the C5 methyl and the isoxazole ring, Arg362 with the 3-Ph, while the m-Bromo binds the Tyr501. Bottom right. Originally incorporated as a spacer, the triazole appears to contribute interactions with Arg362.