8Y0M
beta-glucosidase mutant M279V_T308S_K361R_D433N_N514C
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-5A |
| Synchrotron site | Photon Factory |
| Beamline | BL-5A |
| Temperature [K] | 293 |
| Detector technology | CCD |
| Collection date | 2012-02-21 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.00000 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 138.195, 150.165, 174.892 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.200 - 2.300 |
| R-factor | 0.16277 |
| Rwork | 0.162 |
| R-free | 0.18024 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 1.052 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | REFMAC (5.8.0419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.200 | 2.359 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.124 | 0.050 |
| Number of reflections | 160623 | 11127 |
| <I/σ(I)> | 11.6 | 2.9 |
| Completeness [%] | 99.9 | 99.38 |
| Redundancy | 4.17 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 0.1 M HEPES pH7.0, 0.16 M magnesium chloride, 25% 2-propanol, 0.5 mM 1-deoxynojirimycin |
