3HUR
Crystal structure of alanine racemase from Oenococcus oeni
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 31-ID |
| Synchrotron site | APS |
| Beamline | 31-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-06-12 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.97958 |
| Spacegroup name | F 2 2 2 |
| Unit cell lengths | 118.499, 130.549, 189.441 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.500 |
| R-factor | 0.22 |
| Rwork | 0.219 |
| R-free | 0.25200 |
| Structure solution method | SAD |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.618 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.3.9) |
| Phasing software | SHELXCD |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 26.762 | 2.640 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.097 | 0.365 |
| Number of reflections | 25510 | |
| <I/σ(I)> | 14.7 | 5.3 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 8.3 | 8.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 3.5 | 294 | 100mM citric acid pH 3.5, 2.0M ammonium sulfate, vapor diffusion, temperature 294K |
