3QAG
Human Glutathione Transferase O2 with glutathione -new crystal form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-01-01 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.954448 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 53.138, 53.138, 352.400 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 12.000 - 2.000 |
R-factor | 0.22604 |
Rwork | 0.224 |
R-free | 0.26505 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3q18 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.180 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 12.000 | 2.050 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.084 | 0.346 |
Number of reflections | 19843 | |
<I/σ(I)> | 21.9 | 4.6 |
Completeness [%] | 98.6 | 99.54 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | 0.1M Hepes pH7.5, 2% v/v Polyethylene glycol 400, 2M ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 291K |