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. 2016 Jun 13;10(5):576–589. doi: 10.1080/19336918.2016.1180487

Figure 5.

Figure 5.

(A) Ratio K2D/K3D of the binding constants of lipid-anchored and soluble receptors and ligands and (B) on-rate constant kon of lipid-anchored receptors and ligands vs. average membrane separation l¯ of 2 membranes with area 14 × 14 nm2 and a single lipid-anchored receptor and ligand in our coarse-grained molecular model. The relative membrane roughness is determined by the membrane area in this system and attains the value ξ=0.54±0.01 nm. The data points result from MD simulations. The full lines in (A) result from a fit of our general theoretical results for K2D/K3D from Eqs. (1), (7), and (8) with fit parameters c2D=480±20 nm2, L0=10.64±0.02 nm, and kRL=7.2±0.7 kBT/nm2 for the anchoring strength ka2.5 kBT of our lipid-anchored receptors and ligands. The full lines in (b) result from a fit of our general theoretical results for kon from Eqs. (9), (10), and (2) with fit parameters con=77±4 μm2/s, LTS=10.63±0.02 nm, and kTS=1.5±0.2 kBT/nm2. The dashed lines represent fits to Eqs. (17) and (18) obtained for the classical Gaussian theory with fit parameters (a) K2Dmax=146±9 nm2, lK=9.36±0.06 nm, and ξK=1.08±0.04 nm and (b) konmax=42.1±1.4 μm2/s, lk=9.35±0.05 nm, and ξk=1.41±0.05 nm.