4HY3
Crystal structure of a phosphoglycerate oxidoreductase from rhizobium etli
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X29A |
| Synchrotron site | NSLS |
| Beamline | X29A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-10-16 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 61.733, 121.118, 106.652 |
| Unit cell angles | 90.00, 101.40, 90.00 |
Refinement procedure
| Resolution | 104.550 - 2.800 |
| R-factor | 0.208 |
| Rwork | 0.204 |
| R-free | 0.29100 |
| Structure solution method | SAD |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.736 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SHELXD |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 104.550 | 2.800 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.105 | 0.500 |
| Number of reflections | 37449 | |
| <I/σ(I)> | 11.7 | 1 |
| Completeness [%] | 99.1 | 98.7 |
| Redundancy | 9.7 | 8.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298 | 30% PEG 6000, 0.1M HEPES, 0.1M MgCl2, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
