6GCA
Crystal structure of glutathione transferase Xi 3 from Trametes versicolor
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 | 2014-11-15 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97974 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 146.370, 57.460, 94.560 |
| Unit cell angles | 90.00, 107.32, 90.00 |
Refinement procedure
| Resolution | 36.433 - 2.282 |
| R-factor | 0.1675 |
| Rwork | 0.164 |
| R-free | 0.23070 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ppu |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.090 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.680 | 2.340 |
| High resolution limit [Å] | 2.280 | 2.280 |
| Rmerge | 0.100 | 0.690 |
| Number of reflections | 33851 | |
| <I/σ(I)> | 14 | |
| Completeness [%] | 98.1 | |
| Redundancy | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 6.5 | 277 | 20% (w/v) polyethylene glycol 8,000, 0.1M pH 6.5 sodium cacodylate buffer and 0.2M magnesium acetate |
