1UJM
Crystal structure of aldehyde reductase 2 from Sporobolomyces salmonicolor AKU4429
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 173 |
Detector technology | CCD |
Collection date | 2003-06-28 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.97899, 0.97916, 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 54.869, 83.511, 148.712 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.030 - 2.000 |
R-factor | 0.198 |
Rwork | 0.198 |
R-free | 0.24400 |
Structure solution method | MAD |
RMSD bond length | 0.005 |
RMSD bond angle | 1.200 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | SOLVE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.030 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.059 | 0.104 |
Number of reflections | 47081 | |
<I/σ(I)> | 8 | 6.3 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 7.2 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 277 | 30% PEG MME 2000, 0.1M Na Acetate, 0.2M Ammonium sulfate, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 277K |