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. Author manuscript; available in PMC: 2014 Jan 31.
Published in final edited form as: Cell. 2013 Jan 31;152(3):532–542. doi: 10.1016/j.cell.2013.01.008

Figure 7. Conformational diversity in inactive, active and intermediate states.

Figure 7

Snapshots from MD simulations are shown every 18 ns. Met2155.54, Met2796.41, Tyr2195.58 and Phe2826.44 are shown as sticks. The top panel shows snapshots from a crystallographic- inactive-state simulation with carazolol bound. The middle panel shows snapshots from an active-state simulation with BI-167107 and Nb80 bound. The bottom panel shows frames from the intermediate state (blue), with only BI-167107 bound. In the bottom panel we also show the backbone of crystallographic inactive (orange) and active (green) states.