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(A) Chemical structure of 968. (B) Chemical structure of BPTES. (C) Molecular docking model of 968 complexed with GAC. 968 is modeled to bind a hydrophobic pocket at the monomer-monomer interface of the GAC dimer. (D) x-ray crystallographic structure of human GAC in complex with BPTES (PDB 3UO9). Two BPTES molecules bind at the dimer-dimer interface of the GAC tetramer [56].
(C) adapted from [58].
