8CO4
Crystal structure of apo S-nitrosoglutathione reductase from Arabidopsis thalina
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-02-26 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.97 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 88.600, 93.927, 167.484 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 81.920 - 1.900 |
| R-factor | 0.1634 |
| Rwork | 0.161 |
| R-free | 0.21050 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.045 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 81.920 | 1.930 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.136 | 1.012 |
| Rmeas | 0.167 | 1.245 |
| Rpim | 0.096 | 0.717 |
| Number of reflections | 110542 | 5434 |
| <I/σ(I)> | 7.6 | 1.8 |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 5.4 | |
| CC(1/2) | 0.989 | 0.739 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 0.1M Na(CH3COO), 0.1M Tris-HCl, 20% w/v PEG 4K |
