posted on 2020-05-07, 10:04authored byAalt D. J. van Dijk, Simone Ciofi-Baffoni, Lucia Banci, Ivano Bertini, Rolf Boelens, Alexandre M. J. J. Bonvin
Proper assembly and function of cytochrome c oxidase, which catalyzes the reduction of O2 and
generates the proton gradient driving ATP synthesis, depend on correct copper delivery and
incorporation. Structural details about the protein−protein complexes involved in this process are still
missing. We describe here models of four complexes along this pathway obtained by combining
bioinformatics interface predictions with information-driven docking and discuss their relevance with
respect to known and pathogenic mutations.
Keywords: Docking • cytochrome c oxidase • Cox17 • Sco1 • Cox11 • CoxII • interface prediction • copper delivery
• HADDOCK