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. 2021 Apr 28;11(9):5873–5884. doi: 10.1021/acscatal.1c00417

Figure 5.

Figure 5

Interactions between folate and active site residues and solvent molecules. The H-bond distances are shown as dashed lines and are given in Å. Water molecules are numbered according to the water molecules modeled in the neutron structure (i.e., W47 = DOD47). Note the H+ atom triangulated between the Met20 side chain, W47, and the substrate N5 atom. This is based on the modeled deuteron in the pH 4.5 neutron structure.