4IJR
Crystal structure of Saccharomyces cerevisiae arabinose dehydrogenase Ara1 complexed with NADPH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-04-26 |
| Detector | MARMOSAIC 325 mm CCD |
| Wavelength(s) | 0.999 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.369, 90.568, 69.823 |
| Unit cell angles | 90.00, 90.08, 90.00 |
Refinement procedure
| Resolution | 34.910 - 2.000 |
| R-factor | 0.20839 |
| Rwork | 0.206 |
| R-free | 0.24698 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4ijc |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.337 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.048 | 0.178 |
| Number of reflections | 45854 | |
| <I/σ(I)> | 21.98 | 7.38 |
| Completeness [%] | 98.3 | 95.8 |
| Redundancy | 3.8 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 289 | 25% polyethylene glycol 3350, 0.1M Bis-Tris pH 6.5, 0.05M Cacl2, VAPOR DIFFUSION, HANGING DROP, temperature 289K |
