2R6K
Crystal structure of an I71V hGSTA1-1 mutant in complex with S-hexylglutathione
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 113 |
| Detector technology | IMAGE PLATE |
| Collection date | 2005-04-14 |
| Detector | RIGAKU RAXIS IV |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 98.409, 93.577, 50.717 |
| Unit cell angles | 90.00, 93.05, 90.00 |
Refinement procedure
| Resolution | 20.090 - 2.510 |
| R-factor | 0.2106 |
| Rwork | 0.206 |
| R-free | 0.29829 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1K3L.pdb |
| RMSD bond length | 0.025 |
| RMSD bond angle | 2.317 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.091 | |
| High resolution limit [Å] | 2.510 | 2.510 |
| Number of reflections | 14904 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 297 | 14 mg protein per ml, 0.1M Tris-HCl, 10 mM DTT, 19% PEG4000, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 297K |
