Table 5. DIE Parameters of Association for GalNAc and Glycopeptides in H₂O versus D₂O (DIE = H₂O – D₂O) with hMGL.

ligand	entry	ΔΔG (kcal mol–1)	ΔΔH (kcal mol–1)	Δ−(TΔS) (kcal mol–1)
GalNAc		0.52	–4.49	5.01
MUC1-Thr4	7	0.36	1.10	–0.75
MUC1-Thr9	8	–0.06	3.60	–3.69
MUC1-Thr16	9	0.08	4.18	–4.68
MUC1-Thr9,16	10	0.69	–4.80	5.60
MUC1-Thr4,16	11	0.35	1.80	–1.50
MUC1-Thr4,9	12	0.43	–5.10	5.48
MUC1-Thr4,9,16	13	0.42	–1.80	2.30