Table 4. Structure solution and refinement.
Values in parentheses are for the outer shell.
| PaGT3 + UDP-2FGlc | PaGT3 + kaempferol + UDP-2FGlc | PaGT3 + capsaicin + UDP-2FGlc | |
|---|---|---|---|
| Resolution range (Å) | 48.65–2.20 (2.25–2.20) | 47.14–1.85 (1.89–1.85) | 45.2–2.60 (2.69–2.60) |
| R work/R free (%) | 20.1/22.4 (31.2/37.1) | 20.3/23.6 (26.5/29.6) | 20.7/25.9 (31.1/38.2) |
| R.m.s.d., bond lengths (Å) | 0.008 | 0.015 | 0.009 |
| R.m.s.d., angles (°) | 1.543 | 1.840 | 1.030 |
| Ramachandran plot (%) | |||
| Favoured | 96.59 | 97.36 | 97.63 |
| Allowed | 3.41 | 2.64 | 2.37 |
| Outliers | 90.00 | 0.00 | 0.00 |
| Average B factors (Å2) | |||
| Protein | 57.4 | 41.0 | 56.6 |
| Ligand | 44.8 | 36.8 | 52.6 |
| Ion | 44.4 | 29.1 | 46.5 |
| Water | 47.6 | 41.9 | — |
| PDB code | 7vel | 7vej | 7vek |