3AUU
Crystal structure of Bacillus megaterium glucose dehydrogenase 4 in complex with D-glucose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NW12A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-06-22 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.0000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 65.032, 127.525, 64.519 |
| Unit cell angles | 90.00, 109.95, 90.00 |
Refinement procedure
| Resolution | 28.220 - 2.000 |
| R-factor | 0.20761 |
| Rwork | 0.205 |
| R-free | 0.25719 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.203 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.049 | |
| Number of reflections | 33134 | |
| <I/σ(I)> | 21.3 | 4.7 |
| Completeness [%] | 99.4 | 99.9 |
| Redundancy | 3.8 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1M sodium cacodylate pH 6.5, 0.2M magnesium chloride, 51% PEG 200, 400mM D-glucose, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
