3WEO
Sugar beet alpha-glucosidase with acarviosyl-maltohexaose
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 | 2012-05-26 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 86.166, 99.154, 107.354 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.972 - 1.450 |
R-factor | 0.1239 |
Rwork | 0.123 |
R-free | 0.14990 |
Structure solution method | rigid body refinement |
Starting model (for MR) | 3w37 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.308 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 42.972 | 1.540 | |
High resolution limit [Å] | 1.450 | 4.330 | 1.450 |
Rmerge | 0.100 | 0.074 | 0.498 |
Number of reflections | 162274 | ||
<I/σ(I)> | 8.02 | 15.89 | 2.46 |
Completeness [%] | 99.5 | 95.8 | 99.3 |
Redundancy | 3.66 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 298 | 50mM ammonium sulfate, 50mM sodium acetate buffer, 18% PEG monomethylether 2000, 4.44mM acarviosyl-maltohexaose, pH 4.5, vapor diffusion, hanging drop, temperature 298K |