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. 2010 Nov 16;66(Pt 12):1271–1277. doi: 10.1107/S0907444910035808

Table 3. Intermolecular interactions of the C9-substituents (terminal atom) in the E/Z isomers with the hydrophobic residues in the active site of DHFR.

  Distance (Å) between inhibitor C9 and
  Ile60 CD1 Ile67 CD1 Val115 CG2 Thr56 CD1
mDHFR E1 4.7 5.0 4.4 3.9
mDHFR Z1 3.9 4.3 3.7 3.6
hDHFR Z1 3.9 4.7 4.4 3.6
hDHFR Z3 3.6 4.5 3.4 3.5
hDHFR E2 4.2 4.3 4.0 4.1
hDHFR E4 3.5 4.5 4.0 3.5
hDHFR E5 4.2 3.9 3.5 3.8
hDHFR E6 3.9 4.5 3.5 3.4
hDHFR E7 4.5 4.4 3.5 3.9