5AN1
Crystallographic structure of the Glutathione S-Transferase from Litopenaeus vannamei complexed with Glutathione
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-03-12 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 62.025, 101.943, 166.595 |
| Unit cell angles | 90.00, 90.07, 90.00 |
Refinement procedure
| Resolution | 38.356 - 2.000 |
| R-factor | 0.2146 |
| Rwork | 0.214 |
| R-free | 0.26220 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6gsw |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.246 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.000 | 2.200 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.100 | 0.350 |
| Number of reflections | 135630 | |
| <I/σ(I)> | 8.14 | 4.09 |
| Completeness [%] | 97.4 | 97.2 |
| Redundancy | 4.5 | 4.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8 | 0.2M SODIUM FORMATE,20% PEG3350, pH 8 |
