Carborane-Based Carbonic Anhydrase Inhibitors: Insight into CAII/CAIX Specificity from a High-Resolution Crystal Structure, Modeling, and Quantum Chemical Calculations
Figure 2
Interactions of 1 with CAII. The protein is shown in cartoon representation; residues involved in interactions with the Zn2+ ion (gray sphere) and 1 are shown in stick representation. Polar interactions are represented by blue dashed lines; Zn2+ ion coordination is shown as black dashed lines.
