Table 3 |
|
|
Summary of diffraction data and structure refinement statistics |
|
|
HpFabZ-Emodin |
|
|
|
|
|
Data collection |
|
|
Space group |
P212121 |
|
Cell dimensions |
|
|
a, b, c(Å) |
74.2036, 100.3975, 186.4314 |
|
α, β, γ (°) |
90.00, 90.00, 90.00 |
|
Wavelength (Å) |
1.5418 |
|
Resolution (Å)1 |
20-2.30 (2.42-2.30) |
|
Rmerge (%) |
12.4 (55.5) |
|
I/σI |
18.8 (2.6) |
|
Completeness (%) |
99.6 (98.3) |
|
Redundancy |
8.9 (6.1) |
|
Refinement |
|
|
Resolution (Å) |
20-2.30 (2.42-2.30) |
|
No. reflections |
54135 |
|
Rwork/Rfree |
0.199/0.233 |
|
No. atoms |
|
|
Protein |
7274 |
|
Ligand/ion |
69 |
|
Compound |
40 |
|
Water |
468 |
|
B-factors |
|
|
Protein |
24.081 |
|
Ligand/ion |
38.819 |
|
Water |
29.006 |
|
Compound |
42.133 |
|
R.m.s deviations |
|
|
Bond lengths (Å) |
0.008 |
|
Bond angles (°) |
1.4 |
|
|
|
|
1Numbers in parentheses represent statistics in highest resolution shell |
|
|
Chen et al. BMC Microbiology 2009 9:91 doi:10.1186/1471-2180-9-91 |
|
