Table 3.
CS hexasaccharide (CS06) sequences from the library of 1536 sequences that satisfied the dual-filter CVLS strategy for TGF-β2.
Binding Site | Hexasaccharide Sequence | RMSD (Å) | No of Sulfates | GOLDScore |
---|---|---|---|---|
1 | ZbB–VbC4B–Zb2B–VbC4B–ZbB–VbC6B | 2.5 | 4 | 87.6 |
2 | Zb2B–VbC6B–Zb2B–VbC4B–ZbB–VbC46B | 1.8 | 6 | 85.8 |
Zb2B–VbC6B–ZbB–VbC46B–Zb2B–VbC6B | 2.0 | 6 | 79.0 | |
ZbB–VbC46B–Zb2B–VbC46B–Zb2B–VbC4B | 2.2 | 7 | 71.8 | |
ZbB–VbC46B–Zb2B–VbC4B–Zb2B–VbC46B | 1.6 | 7 | 82.7 | |
ZbB–VbC46B–Zb2B–VbC4B–Zb2B–VbC6B | 1.6 | 6 | 88.4 | |
ZbB–VbC46B–Zb2B–VbCB–Zb2B–VbC46B | 2.2 | 6 | 86.7 | |
ZbB–VbC46B–Zb2B–VbCB–ZbB–VbC6B | 2.1 | 4 | 71.7 | |
ZbB–VbC46B–ZbB–VbC46B–ZbB–VbC4B | 1.8 | 5 | 70.3 |