6R5V
The crystal structure of Glycoside Hydrolase BglX inactive mutant D286N from P. aeruginosa in complex with xylotriose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-09-22 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.979257 |
Spacegroup name | P 1 |
Unit cell lengths | 70.955, 73.668, 81.444 |
Unit cell angles | 65.55, 73.46, 69.66 |
Refinement procedure
Resolution | 45.270 - 1.800 |
R-factor | 0.16451 |
Rwork | 0.163 |
R-free | 0.19654 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5tf0 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.674 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.270 | 1.830 |
High resolution limit [Å] | 1.800 | 1.800 |
Rpim | 0.080 | 0.420 |
Number of reflections | 123955 | 6063 |
<I/σ(I)> | 8.1 | |
Completeness [%] | 96.3 | |
Redundancy | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 291 | 100 mM Bis Tris, pH 5.5, 17% PEG 10000 and 100 mM ammonium acetate |