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. 2020 Jun 24;11(7):1377–1385. doi: 10.1021/acsmedchemlett.0c00042

Table 2. Affinity Energies for Substrates against GALNS Crystal Structure with FGly79 or Cys79.

  Affinity energy (kcal mol–1)
Substrate GALNS–Cys79 GALNS–FGly79
KS –7.7 –8.3
C6S –6.3 –6.7
G6S –5.2 –5.7
4MUGPS –5.4 –5.7