Data set | SfSFGH |
---|---|
X-ray source | PAL-5C beam line |
Space group | P21 |
Unit-cell parameters (Å, °) | a = 49.4, b = 76.6, c = 64.7, α = γ = 90, and β = 105.3 |
Wavelength (Ã…) | 0.9796 |
Resolution (Å) | 50.00–2.32 (2.36–2.32) |
Total reflections | 69,131 |
Unique reflections | 19,691 (911) |
Average I/σ (I) | 42.7 (22.4) |
R amerge | 0.067 (0.165) |
Redundancy | 3.5 (3.5) |
Completeness (%) | 97.0 (90.2) |
Refinement | Â |
Resolution range (Å) | 33.81–2.32 (2.38–2.32) |
No. of reflections of working set | 18,706 (1341) |
No. of reflections of test set | 964 (47) |
No. of amino acid residues | 554 |
No. of water molecules | 208 |
R bcryst | 0.176 (0.165) |
R cfree | 0.235 (0.239) |
R.m.s. bond length (Ã…) | 0.0096 |
R.m.s. bond length (°) | 1.596 |
Average B value (Ã…2) (protein) | 27.9 |
Average B value (Ã…2) (solvent) | 31.0 |