5H47
Crystal structure of AOL complexed with 2-MeSe-Fuc
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-1A |
Synchrotron site | Photon Factory |
Beamline | BL-1A |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-10-23 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.9790 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 105.972, 214.316, 126.531 |
Unit cell angles | 90.00, 108.24, 90.00 |
Refinement procedure
Resolution | 39.990 - 2.300 |
R-factor | 0.21801 |
Rwork | 0.216 |
R-free | 0.25838 |
Structure solution method | SAD |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | AutoSol |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.050 | 2.240 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.213 | 1.837 |
Number of reflections | 270453 | |
<I/σ(I)> | 8.9 | 1 |
Completeness [%] | 100.0 | 100 |
Redundancy | 7 | 7.2 |
CC(1/2) | 0.995 | 0.630 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | Tryptone, HEPES, PEG 3350 |