|
Crystallographic data and refinement statistics |
|
| Data collection |
|
|
|
|
| Beamline |
ALS 8.2.1 |
| Wavelength (Å) |
1.2547 |
| Space group |
I422 |
| Unit cell |
a = 100.3 Å, b = 100.3 Å, c = 104.9 Å α = 90°, β = 90°, γ = 90° |
| Resolution (Å)* |
36.25–1.75 (1.84–1.75) |
| Rmerge (%)* |
8.3 (55.9) |
| I/σ (I) * |
22 (3.9) |
| Completeness (%)* |
99.9 (99.9) |
| Redundancy* |
9.2 (9.3) |
| Refinement |
|
| Unique reflections |
27265 |
| Free R test set (% of total data) |
5.12 |
| Rwork/Rfree (%) |
15.0/18.2 |
| Monomers per asymmetric unit |
1 |
| Number of non-hydrogen atoms |
2166 |
| Protein |
1847 |
| Ligand (imatinib, FAD, MRD) |
106 |
| Water |
213 |
| r.m.s. deviation, bond lengths (Å) |
0.012 |
| r.m.s. deviation, bond angles (Å) |
1.093 |
|
* Outer resolution shell and statistics for that shell are in parentheses | |
Winger et al. BMC Structural Biology 2009 9:7 doi:10.1186/1472-6807-9-7 |
|