3WYW
Structural characterization of catalytic site of a Nilaparvata lugens delta-class glutathione transferase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 90 |
| Detector technology | CCD |
| Collection date | 2013-11-23 |
| Wavelength(s) | 0.9 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.552, 49.104, 74.184 |
| Unit cell angles | 90.00, 99.90, 90.00 |
Refinement procedure
| Resolution | 36.500 - 1.700 |
| R-factor | 0.17676 |
| Rwork | 0.175 |
| R-free | 0.21715 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.720 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MERLOT |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.540 | 1.730 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Number of reflections | 42310 | |
| Completeness [%] | 21.2 | 98.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | 1M LiCl2, 30% PEG 6000, pH 8, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
