Biophysical Approaches Facilitate Computational Drug Discovery for ATP-Binding Cassette Proteins

Figure 2

Experimental workflow from biophysical characterization of ABC proteins in multiple conformational states to in silico discovery and design of small molecule modulators. Biophysical techniques are shown in green boxes (a), multiple conformations of a representative ABC protein are shown in the blue box (b), and in silico methods are shown in orange boxes (c). The cryo-EM image is modified from [39].