Figure 8 | Scientific Reports

Figure 8

From: Molecular Diversity and Potential Anti-neuroinflammatory Activities of Cyathane Diterpenoids from the Basidiomycete Cyathus africanus

Figure 8The alternative text for this image may have been generated using AI.

Molecular docking simulations of the binding of compounds 11 and 14 to iNOS and COX-2. Virtual drug-protein complexes including compounds 11 (A) and 14 (B) for iNOS, and 11 (C) for COX-2 were obtained at lowest energy conformation, while potential hydrogen contacts between compounds and proteins were highlighted by dashed lines. Atoms were colored as follows: carbon, cyan; nitrogen, blue; oxygen, red; hydrogen, gray; sulfur, orange.

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