3WNV
Crystal structure of a glyoxylate reductase from Paecilomyes thermophila
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 | 2012-06-24 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.374, 62.763, 148.610 |
| Unit cell angles | 90.00, 94.28, 90.00 |
Refinement procedure
| Resolution | 49.398 - 1.750 |
| R-factor | 0.1917 |
| Rwork | 0.190 |
| R-free | 0.21530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2w2l |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.439 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.8.1_1168)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.780 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.080 | 0.510 |
| Number of reflections | 82515 | |
| <I/σ(I)> | 13.95 | 4.79 |
| Completeness [%] | 98.4 | 97.3 |
| Redundancy | 5.5 | 5.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 0.1M MES buffer pH 6.5, 0.01M cobalt (II) chloride, 1.8M ammonium sulfate, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
