Phosphorylation-dependent activity-based conformational changes in P21-activated kinase family members and screening of novel ATP competitive inhibitors
Fig 4
Comparative surface view analysis of group-I PAKs on the basis of MD simulation.
Surface view of (A and B) PAK1 and PAK1Tpo423, (C and D) inactive and active PAK1, rotated at 180°, (E and F) PAK2 and PAK2Tpo402, (G and H) inactive and active PAK2, rotated at 180°, (I and J) PAK3 and PAK3Tpo436, (K and L) inactive and active PAK3, rotated at 180°. Surface view color code: C-lobe and activation loop are shown in light blue, white and lime green colors, respectively. Gly-loop is shown in orange red color. β6, β7 and β8-strands are shown in deep pink colors, respectively. These color codes are used for all the Surface view representation for group-I and group-II PAKs structures.