3UKO
Crystal Structure of S-Nitrosoglutathione Reductase from Arabidopsis thaliana, complex with NADH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 14-BM-C |
| Synchrotron site | APS |
| Beamline | 14-BM-C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-04-16 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9002 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 92.244, 92.244, 172.872 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 38.920 - 1.400 |
| R-factor | 0.18273 |
| Rwork | 0.180 |
| R-free | 0.23413 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1m6h |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.941 |
| Data reduction software | d*TREK |
| Data scaling software | CrystalClear |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.000 | 1.450 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Rmerge | 0.070 | 0.328 |
| Number of reflections | 166757 | |
| <I/σ(I)> | 13.9 | 3.8 |
| Completeness [%] | 99.5 | 99.5 |
| Redundancy | 7.1 | 5.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 2.1 M ammonium sulfate, 100 mM Hepes pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
