3M0F
Crystal structure of Glutathione S Transferase in complex with glutathione from Pseudomonas fluorescens
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 | 2010-02-26 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 48.521, 57.866, 74.796 |
| Unit cell angles | 90.00, 106.00, 90.00 |
Refinement procedure
| Resolution | 45.080 - 1.600 |
| R-factor | 0.205 |
| Rwork | 0.205 |
| R-free | 0.22000 |
| Structure solution method | SAD |
| Starting model (for MR) | None |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.300 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | SHELXD |
| Refinement software | CCP4 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.660 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.060 | 0.450 |
| Number of reflections | 52483 | |
| <I/σ(I)> | 10.1 | 4 |
| Completeness [%] | 98.2 | 82.8 |
| Redundancy | 12.2 | 11 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 277 | 0.2M MgCL2, 0.1M Bis-tris, 25% PEG 3350, 6% methanol, 2mM glutathione, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
