1AQW
GLUTATHIONE S-TRANSFERASE IN COMPLEX WITH GLUTATHIONE
Experimental procedure
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH2R |
| Temperature [K] | 291 |
| Detector technology | IMAGE PLATE |
| Collection date | 1995-08-15 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 90.290, 74.670, 69.500 |
| Unit cell angles | 90.00, 90.07, 90.00 |
Refinement procedure
| Resolution | 8.000 - 1.800 |
| R-factor | 0.206 |
| Rwork | 0.206 |
| R-free | 0.26100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 21.756 * |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 ((AGROVATA) |
| Phasing software | AMoRE |
| Refinement software | X-PLOR (3.5) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 18.600 | 1.850 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.075 | 0.388 |
| Total number of observations | 164829 * | |
| Number of reflections | 80112 | |
| Completeness [%] | 93.7 | |
| Redundancy | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion * | 6.5 | 20 * | pH 6.5 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | PEG8000 | 10 (%) | |
| 2 | 1 | drop | MES-NaOH | 33 (mM) | |
| 3 | 1 | drop | 67 (mM) | ||
| 4 | 1 | drop | protein | 13 (mg/ml) | |
| 5 | 1 | reservoir | PEG8000 | 30 (%) | |
| 6 | 1 | reservoir | MES-NaOH | 100 (mM) | |
| 7 | 1 | reservoir | 200 (mM) |
