5LVX
Crystal structure of glucocerebrosidase with an inhibitory quinazoline modulator
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-09-16 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.999 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 94.910, 132.281, 103.085 |
Unit cell angles | 90.00, 95.26, 90.00 |
Refinement procedure
Resolution | 102.650 - 2.200 |
R-factor | 0.18907 |
Rwork | 0.189 |
R-free | 0.21014 |
Structure solution method | OTHER |
RMSD bond length | 0.008 |
RMSD bond angle | 1.545 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 102.650 | 2.450 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.061 | 0.431 |
Number of reflections | 125199 | |
Completeness [%] | 97.5 | 98.3 |
Redundancy | 2.2 | 2.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 4.5 | 293 | 20 %w/v PEG 3350 0.2 M (NH4)2SO4 0.1 M Na Acet pH=4.50 0.50 %w/v LDAO |