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 |