Table 1. X-ray data collection and refinement statistics of NEPv in complex with phosphoramidon.
| Data collection | |
| Space group | P3221 |
| Unit cell dimensions | |
| (Å) | a = b = 108.80, c = 112.94 |
| (°) | α = β = 90.0, γ = 120.0 |
| Resolution range (Å) | 43.48–2.15 (2.21–2.15) |
| No. of observations | 390649 |
| No. of unique reflections | 42405 |
| Data redundancy | 9.2 (8.0) |
| Data completeness (%) | 99.8 (99.8) |
| < I/σ(I)> | 16.4 (2.0) |
| R merge (%) | 9.8 (127) |
| Refinement | |
| Resolution range (Å) | 31.48–2.15 (2.21–2.15) |
| R work (%) | 20.9 (41.0) |
| R free (%) | 26.1 (44.3) |
| Wilson B-factor (Å2) | 42.4 |
| Overall mean B-factor (Å2) | 47.5 |
| No. of atoms | |
| Protein atoms | 5611 |
| Heterogen atoms | 453 |
| Solvent atoms | 325 |
| r.m.s.d. values | |
| Bond lengths (Å) | 0.010 |
| Bond angles (°) | 1.09 |
| Ramachandran statistics (%) (PROCHECK (Laskowski, 1993)) | |
| Most favoured + additional allowed | 99.8 |
| Disallowed | 0.2 |