Zhang and Bruice. 10.1073/pnas.0601587103. |
Supporting Figure 8
Supporting Figure 9
Fig. 8. The structures with large quantum mechanics regions [CH2-S+(Me)-CH2 of AdoMet cofactor; side chains of Cys-81, Glu-119, Arg-163, Arg-165; Wat-330, and Wat-340; and the pyrimidine ring of cytosine] in the ground state.
Fig. 9. The structures with large quantum mechanics regions [CH2-S+(Me)-CH2 of AdoMet cofactor; side chains of Cys-81, Glu-119, Arg-163, Arg-165; Wat-330, and Wat-340; and the pyrimidine ring of cytosine] in the transition state (TS).