Figure 2

Heatmap LGA alignments of MBL library against NDM-1. Parameters for LGA were set using a maximal 4.0 Å distance, under side chain comparison. Coloring was set to > 2 Å (at 2 Å increments) from green to yellow to orange to red to gray. Notable areas of interested are framed using the same ranges as in Figure 1, and include regions of major structural misalignment, such as the L3 mobile flap and the linker region.