HIGHLIGHTS
SUMMARY
In contrast, unlike the hydrogen_bond between the amide group of capsaicin and residue Thr551, docking suggested that there was no hydrogen_bond between AEA and residue Thr551, which was supported by the results that mutation of Thr551V did not largely alter the AEA activation. The most strongly interacting amino_acids are Ala680 and Asn687 (hydrophobic bonds) and Gly683 (hydrogen_bond with 2-hydroxi moiety). A molecular docking study indicated that stigmasterol establishes via the hydroxyl group in position C-3 of the steroid skeleton two hydrogen_bonds with residues Arg557 and Gln700, respectively, while rings A and B . . .
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