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. 2021 Sep 1;595(18):2366–2382. doi: 10.1002/1873-3468.14182

Fig. 8.

Fig. 8

Intermolecular interactions between favipiravir and the RdRp complex for the top‐scoring designs. Intermolecular interactions between favipiravir and the RdRp complex for the top‐scored (A) affinity‐enhancing designs and (B) affinity‐attenuating designs. Interacting residues of corresponding nsp12 (green) and RNA bases with favipiravir (yellow) and Mg2+ (green sphere) coordinating the favipiravir‐RTP are shown. Hydrogen bonds are shown as black dashes. (C) 2D ligand interaction diagrams of RdRp‐favipiravir complex for the top‐scored affinity‐enhancing and (D) affinity‐attenuating design. The intermolecular interactions are labelled below.