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Glide-SP docking poses of (A) the 5′(R)-CH3 and (B) the 5′(S)-CF3 analogs of FdUMP in hTS (PDB 6QXG) overlaid with FdUMP (in yellow) from the cocrystal structure. (C) Graphical representation of the “substitution tolerant” zone (green sphere) and the “substitution intolerant” zone (red sphere).
