4ZBD
Crystal structure of the glutathione transferase URE2P6 from Phanerochaete chrysosporium in complex with glutathione reduced by X-ray irradiation at 100K
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 | 2013-12-02 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.999 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 93.455, 50.096, 97.141 |
| Unit cell angles | 90.00, 96.03, 90.00 |
Refinement procedure
| Resolution | 26.646 - 1.120 |
| R-factor | 0.1184 |
| Rwork | 0.117 |
| R-free | 0.14410 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4zb8 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.500 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.300 | 1.200 |
| High resolution limit [Å] | 1.100 | 1.100 |
| Rmerge | 0.067 | 0.157 |
| Number of reflections | 198807 | |
| <I/σ(I)> | 16.4 | 6.7 |
| Completeness [%] | 95.9 | 90.9 |
| Redundancy | 5.5 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 278 | 30 % PEG4000, 10mM TRIS pH8.5, 0.2M Sodium Acetate |
