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

Table 1. Summary of Interactions Predicted between Substrates and GALNS Crystal Structure^a.

Substrate	Hydrogen bonds	Hydrophobicinteractions
KS	FGly79, Tyr108 Gln111, Arg175 His236, Lys310Ser521	Leu78, Pro110, Glu112, His142, Phe167, Ile294, Cys489, Trp520, His522.
C6S	Asn106, Tyr108 His236, Lys310 Gln311, Ser521	Leu78, FGly79, His142, Ile294, Trp520.
G6S	Asn106, Lys310 Ser521	Leu78, Tyr108, His236, Gln311.
4MUGPS	Lys140, His236 Lys310	FGly 79, Asn106, Tyr108, His142, Ile294, Gln311, Ile416, Phe418, Trp520, Ser521.

Interactions were predicted by using LigPlot+ v.2.2.

Table 1. Summary of Interactions Predicted between Substrates and GALNS Crystal Structurea.