|
Figure 4.
Fig. 4. Electrostatic surface potentials, calculated using
the Adaptive Poisson–Boltzmann Solver^21 of (a) 4ANK (PDB code
1N0R) and (b) NI[3]C. Both representations show the concave
binding site with the N- and C-termini on the right and left
sides, respectively. Bound sulfate ions in the NI[3]C molecule
are shown as spheres. Both surfaces were in blue and red for
positive and negative electrostatic charge densities (same
scale), respectively.
|
