Skip to main content
. 2021 Nov 15;61(12):6024–6037. doi: 10.1021/acs.jcim.1c00826

Figure 1.

Figure 1

Structure of the β2AR-Nb80: A molecular dynamics snapshot of BI167107-bound β2AR with Nb80 in the active-like state (simulation starting structure: PDB 3P0G(26)) and ligands examined in this study: agonists BI167107 and adrenaline; biased partial agonist salmeterol; inverse agonist carazolol, and antagonists timolol and alprenolol. The receptor is represented as white cartoon, Nb80 as red ribbons, the bound ligand as green sticks, and transparent surface.