Table 1.
Data collection and refinement statistics
| Data set 1 | Data set 2 | Merged | |
| Data collection | |||
| Space group | P3121 | P3121 | P3121 |
| Cell dimensions | |||
| a, b, c (Å) | 157.5, 157.5, 61.8 | 157.2, 157.2, 61.8 | 157.3, 157.3, 61.8 |
| α, β, γ (°) | 90, 90, 120 | 90, 90, 120 | 90, 90, 120 |
| Resolution (Å) | 50–3.5 (3.69–3.5) | 50–3.25 (3.43–3.25) | 50–3.25 (3.43–3.25) |
| Rpim (%) | 13.5 (51.3) | 6.9 (33.5) | 11.2 (33.5) |
| Rmerge (%) | 18.5 (99.3) | 13.9 (98.8) | |
| I/σI | 8.3 (1.9) | 11.2 (2.3) | 12.3 (2.3) |
| Completeness (%) | 100 (100) | 87.1 (89.1) | 100 (89.1) |
| Redundancy | 7.1 (7.3) | 6.0 (6.0) | 12.3 (6.0) |
| Refinement | |||
| Resolution (Å) | 50–3.25 (3.33–3.25) | ||
| No. reflections | 12,130 (1,940) | ||
| Rwork/Rfree* | 22.6/25.1 (33.1/35.2) | ||
| No. molecules in ASU | 1 | ||
| No. atoms | |||
| Protein | 3,115 | ||
| Carbohydrate | 42 | ||
| Water | 0 | ||
| B factors | |||
| Overall | 102.8 | ||
| Peptide | 101.1 | ||
| Carbohydrates | 116.3 | ||
| Rmsd | |||
| Bond lengths (Å) | 0.007 | ||
| Bond angles (°) | 1.15 |
Rpim, redundancy-independent merging R factor; ASU, asymmetric units. Data for outer shell shown in parentheses.
*Rfree test set size 5%, 704.