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Fig. 2 | Journal of Cheminformatics

Fig. 2

From: 2D SIFt: a matrix of ligand-receptor interactions

Fig. 2

Differences between agonistic and antagonistic binding site for β2-AR. Depicted by the 2D-SIFt profile for agonists (red) and antagonists (blue) (A), and visualized in the crystal structure of β2-AR, 2RH1 (B). Residues in white are common to both binding modes, blue is unique to antagonist binding and red is unique to agonist binding. For clarity, the 2D-SIFt heatmaps display the per-residue interactions found in more than 30% of the investigated complexes

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