MFPred: Rapid and accurate prediction of protein-peptide recognition multispecificity using self-consistent mean field theory
Fig 5
Changes in specificity profile upon granzyme B protease mutation are recapitulated by MFPred. (a) Experimental (bold) specificity (average of Harris et al. [46] and Ruggles et al. [47]) and predicted P3 specificity for WT granzyme B protease. (b)-(c), WT granzyme B protease structure. (d) R192E granzyme B protease active site. (e) Experimental specificity (bold) [46] and predicted P3 specificity for R192E granzyme B protease. (f) R192E/N218A granzyme B protease active site. (g) Experimental specificity (bold) [47] and predicted P3 specificity for R192E/N218A granzyme B protease.