Table 1. Data-collection and refinement statistics.
Data collection | |
Resolution (Å) | 39.2–1.9 (2.0–1.9) |
Completeness (%) | 99.6 (100) |
Average redundancy | 4.9 (4.9) |
I/σ(I) | 7.7 (1.9) |
Rmerge† | 0.072 (0.386) |
Space group | P21212 |
Unit-cell parameters (Å, °) | a = 65.5, b = 85.4, c = 59.7, α = β = γ = 90.0 |
Reflections | 26897 (3897) |
Wilson B factor (Å2) | 22.9 |
Refinement statistics | |
Rwork | 0.184 (0.234) |
Rfree | 0.199 (0.303) |
Rwork reflections | 25546 |
Rfree reflections | 1351 |
No. of atoms | |
Protein | 2567 [335 residues] |
PLP | 16 |
Solvent | 281 |
Average B factors (Å2) | |
Protein | 22.7 |
PLP | 15.0 |
Solvent | 31.1 |
R.m.s.d. from ideal geometry‡ | |
Bond lengths (Å) | 0.011 |
Bond angles (°) | 1.4 |
Ramachandran plot (%) | |
Favored | 97.6 |
Outliers | 0.0 |
PDB code | 3ht5 |
R merge = .
Engh & Huber (1991 ▶).