3M3M
Crystal structure of glutathione S-transferase from Pseudomonas fluorescens [Pf-5]
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-02-26 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.979 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 101.746, 101.746, 48.880 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.430 - 1.750 |
R-factor | 0.16049 |
Rwork | 0.159 |
R-free | 0.19626 |
Structure solution method | SAD |
RMSD bond length | 0.030 |
RMSD bond angle | 2.220 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHARP |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.430 | 1.790 |
High resolution limit [Å] | 1.750 | 1.750 |
Rmerge | 0.105 | 0.292 |
Number of reflections | 24949 | |
<I/σ(I)> | 15.4 | 2.5 |
Completeness [%] | 99.5 | 98.37 |
Redundancy | 10 | 8.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298 | 60%v/v Tacsimate pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 298 K |