Figures & data
Table 1. LC-HRESIMS-dereplicated phytochemicals in the methanol extract of Thunbergia grandifolia.
Figure 2. Binding modes of diphyllin (left side) inside the active site of rhodesain target. Binding mode of co-crystalized ligand (right side) inside the active site of rhodesain.
![Figure 2. Binding modes of diphyllin (left side) inside the active site of rhodesain target. Binding mode of co-crystalized ligand (right side) inside the active site of rhodesain.](/cms/asset/c762c4aa-f285-4852-a7cf-2a036203c193/ienz_a_2199950_f0002_c.jpg)
Figure 3. Binding modes of avicennone B (left side) inside the active site of farnesyl diphosphate synthase target. Binding mode of co-crystalized ligand (right side) inside the active site of farnesyl diphosphate synthase.
![Figure 3. Binding modes of avicennone B (left side) inside the active site of farnesyl diphosphate synthase target. Binding mode of co-crystalized ligand (right side) inside the active site of farnesyl diphosphate synthase.](/cms/asset/50792890-e199-48ab-a2c5-a8faa3bc4149/ienz_a_2199950_f0003_c.jpg)
Figure 4. RMSDs of diphyllin and avacennone B inside the active sites of rhodesain and farnesyl diphosphate synthase, respectively, over 50 ns of MDS.
![Figure 4. RMSDs of diphyllin and avacennone B inside the active sites of rhodesain and farnesyl diphosphate synthase, respectively, over 50 ns of MDS.](/cms/asset/fb66048b-ab1a-4129-bea1-07cd7f9bae83/ienz_a_2199950_f0004_c.jpg)