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RMSF analysis of key residues in allopurinol and phenolic compounds. (A) Glu802; (B) Phe914; (C) Phe1009; (D) Thr1010; and (E) Val1011. RMSF, root-mean-square fluctuations; C1, quercetin; C2, quercetin-3-rhamnoside; C3, 4,5-O-dicaffeoylquinic acid; C4, 3,5-O-dicaffeoylquinic acid; C5, 3,4-O-di-caffeoylquinic acid; C6, 4-O-caffeoylquinic acid; C7, 3-O-caffeoylquinic acid; and C8, caffeic acid.
