fig5
![<i>Bulbine frutescens</i> phytochemicals as novel ABC-transporter inhibitor: a molecular docking and molecular dynamics simulation study](https://image.oaes.cc/05a5bf19-7adc-40dc-8589-91dd5f39b27c/3854.fig.5.jpg)
Figure 5. (A) The RMSD of unbound protein (ABC transporter) and bound protein-ligand (ABC transporter-4’-Demethylknipholone 2’-β-D-glucopyranoside) complex along the 5 ns of simulation time; (B) time evolution of radius of gyration value during 5 ns of MD simulation; and (C) RMSF plot during the 5 ns of simulation time. Black and yellow color peaks represent unbound protein and bound protein-ligand complex, respectively. RMSD: Root Mean Square Deviation; RMSF: root mean square fluctuation; ABC transporter: ATP-binding cassette transporter