TABLE 1.
Parameter | Value |
---|---|
Space group | P212121 |
Resolution limits (Å) | 42.15–2.05 (2.16–2.05)a |
Unit cell parameters | |
a, b, c (Å) | 39.77, 80.82, 84.32 |
α = β = γ (degrees) | 90 |
No. of unique reflections | 17,734 |
Multiplicity | 4.8 |
Completeness (%) | 100 (99.9) |
Mean I/σ(I) | 12.3 (2.9) |
Rsym (Rmerge) (%) | 8.3 (55.6) |
Rwork (%) | 18.9 |
Rfree (%) | 24.6 |
No. of protein residues | 283 |
No. of water molecules | 57 |
Mean protein B factor (Å2) | 30.8 |
Mean solvent B factor (Å2) | 64.8 |
Root mean square deviation bond lengths (Å) | 0.014 |
Root mean square deviation bond angles (degrees) | 1.548 |
Ramachandran plot statistics (%) | |
Residues in most favored regions | 97.2 |
Residues in additional allowed regions | 2.8 |
a Values in parentheses refer to the highest resolution shell.