1XW5
Human glutathione s-transferase M2-2 (E.C.2.5.1.18)complexed with glutathione, monoclinic crystal form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2004-10-11 |
Detector | RIGAKU |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 51.200, 49.790, 92.040 |
Unit cell angles | 90.00, 94.27, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.800 |
R-factor | 0.206 |
Rwork | 0.206 |
R-free | 0.23200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2gtu |
RMSD bond length | 0.009 |
RMSD bond angle | 1.300 |
Data scaling software | SCALEPACK |
Phasing software | CCP4 |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.860 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.064 | 0.017 |
Number of reflections | 38664 | |
<I/σ(I)> | 11.6 | 2.2 |
Completeness [%] | 89.3 | 43.3 |
Redundancy | 7.7 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.5 | 290 | 20% PEG4000, pH 6.50, VAPOR DIFFUSION, temperature 290K |