3BVS
Crystal Structure of Bacillus cereus Alkylpurine DNA Glycosylase AlkD
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-D |
| Synchrotron site | APS |
| Beamline | 21-ID-D |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2006-12-17 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 43 |
| Unit cell lengths | 77.917, 77.917, 55.102 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.100 |
| R-factor | 0.18974 |
| Rwork | 0.188 |
| R-free | 0.22718 |
| Structure solution method | SAD |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.571 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SHARP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.500 | 2.080 |
| High resolution limit [Å] | 2.080 | 2.080 |
| Rmerge | 0.046 | 0.531 |
| Number of reflections | 19887 | |
| <I/σ(I)> | 26.9 | 3.4 |
| Completeness [%] | 99.1 | 95.3 |
| Redundancy | 7.1 | 6.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 294 | 85 mM HEPES pH 7.5, 15% PEG 4000, 17% glycerol, VAPOR DIFFUSION, SITTING DROP, temperature 294K |
