Table 1.
statistics | DAC |
---|---|
PDB code | 3D6N |
crystals | 1 |
space group | H32 |
unit cell dimension | |
a (Å) | 158.43 |
b (Å) | 158.43 |
c (Å) | 233.55 |
α (deg) | 90 |
β (deg) | 90 |
γ (deg) | 120 |
chains per asymmetric unit | 1 DHO, 1 ATC |
Data Collection | |
resolution (Å) | 47.4–2.3 (2.38–2.30) |
reflections used | 47614 |
completeness (%) | 99.9 (99.4) |
average (I/σ) | 23.8 (3.0) |
Rmerge (%) | 8.0 (54.6) |
Refinement | |
R factor | 0.164 |
Rfree (%) | 0.204 |
average B factor (Å2) | 34.2 |
atoms in asymmetric unit | 6082 |
no. of water molecules | 423 |
rms bond (Å) | 0.020 |
rms angle (deg) | 1.811 |
rms chiral | 0.136 |