Figure 1.
Arrangement of the QM region with the triphosphate chain (red and gold) of ATP and surrounding residues. 4 waters along with the magnesium ion were also treated quantum mechanically.
Official websites use .gov
A
.gov website belongs to an official
government organization in the United States.
Secure .gov websites use HTTPS
A lock (
) or https:// means you've safely
connected to the .gov website. Share sensitive
information only on official, secure websites.