4UP7
Crystal structure of Entamoeba histolytica lysyl-tRNA synthetase in complex with lysyl-adenylate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-12-12 |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | P 62 |
Unit cell lengths | 155.765, 155.765, 95.292 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 36.047 - 2.789 |
R-factor | 0.2063 |
Rwork | 0.205 |
R-free | 0.22520 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3bju |
RMSD bond length | 0.003 |
RMSD bond angle | 0.801 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 37.400 | 2.950 |
High resolution limit [Å] | 2.800 | 2.800 |
Rmerge | 0.130 | |
Number of reflections | 32784 | |
<I/σ(I)> | 22.8 | 1.8 |
Completeness [%] | 99.5 | 96.9 |
Redundancy | 22.8 | 22.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | 50 MM HEPES PH 8.0, 50 MM NACL, 1 MM SPERMINE, 8% PEG 4000 |