4GL4
Crystal structure of oxidized S-nitrosoglutathione reductase from Arabidopsis thalina, complex with NADH
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-05-18 |
Detector | MARMOSAIC 325 mm CCD |
Wavelength(s) | 0.9795 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 91.634, 91.634, 173.184 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 27.130 - 1.800 |
R-factor | 0.19834 |
Rwork | 0.196 |
R-free | 0.23604 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 3uko |
RMSD bond length | 0.015 |
RMSD bond angle | 1.756 |
Data reduction software | CrystalClear |
Data scaling software | CrystalClear |
Phasing software | REFMAC |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 27.200 | 1.760 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.072 | 0.390 |
Number of reflections | 93100 | |
<I/σ(I)> | 10.8 | 3.2 |
Completeness [%] | 100 | |
Redundancy | 11.4 | 10 |
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 |