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 |