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 |