6G62
Crystal structure of thioredoxin O2 from Arabidopsis thaliana in oxidized state
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM30A |
| Synchrotron site | ESRF |
| Beamline | BM30A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-03-21 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9815 |
| Spacegroup name | P 65 |
| Unit cell lengths | 70.806, 70.806, 35.755 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 35.403 - 1.500 |
| R-factor | 0.168 |
| Rwork | 0.167 |
| R-free | 0.17930 |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.528 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Refinement software | PHENIX ((dev_2722: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.403 | 1.530 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.070 | 0.432 |
| Rmeas | 0.075 | 0.500 |
| Rpim | 0.028 | 0.251 |
| Number of reflections | 16473 | 814 |
| <I/σ(I)> | 20 | 3.1 |
| Completeness [%] | 99.4 | 100 |
| Redundancy | 12 | 7.3 |
| CC(1/2) | 0.997 | 0.942 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 277 | 100 mM citrate buffer (pH 5.6) 30% PEG 4000 100 mM ammonium sulfate |
