Skip to main content
. Author manuscript; available in PMC: 2010 Oct 20.
Published in final edited form as: Biochemistry. 2009 Oct 20;48(41):9839. doi: 10.1021/bi901118r

Fig. 6.

Fig. 6

Energy profiles for SB-3CT (3) and its oxirane analog (4) in the MMP2 active site. Relative energies (in kcal/mol) were calculated at ONIOM(B3LYP/6-311+G(d,p):AMBER) using electronic embedding with the reactant complexes used as reference states.