A. Takagi et al., INHIBITION MECHANISMS OF STAUROSPORINE AND H7 TO CAMP-DEPENDENT PROTEIN-KINASE THROUGH DOCKING STUDY, Chemical and Pharmaceutical Bulletin, 44(3), 1996, pp. 618-620
Inhibition mechanisms of staurosporine and H7 to cAMP-dependent protei
n kinase have been investigated through docking studies. For each mole
cule, the energetically most stable docking model was searched by usin
g the conformationally flexible automatic docking program ADAM without
any presumptions. The results explain well the observation that staur
osporine does not bind to the enzyme competitively with H7, even thoug
h the two compounds competitively inhibit ATP binding.