3LXZ
Structure of probable Glutathione S-transferase(PP0183) from Pseudomonas putida
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-01-27 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9793 |
Spacegroup name | P 1 |
Unit cell lengths | 48.047, 66.358, 88.659 |
Unit cell angles | 89.96, 85.27, 87.04 |
Refinement procedure
Resolution | 50.000 - 1.760 |
R-factor | 0.197 |
Rwork | 0.196 |
R-free | 0.22900 |
Structure solution method | SAD |
RMSD bond length | 0.015 |
RMSD bond angle | 1.519 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHELXD |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.790 |
High resolution limit [Å] | 1.760 | 4.780 | 1.760 |
Rmerge | 0.091 | 0.071 | 0.426 |
Number of reflections | 98088 | ||
<I/σ(I)> | 12.1 | ||
Completeness [%] | 91.4 | 98.1 | 93.7 |
Redundancy | 3.1 | 3.2 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298 | 1.1M Ammonium(di-) Tartrate pH 7, Vapor diffusion, Sitting drop, temperature 298K |