9URF
Crystal structure of beta-glucosidase from Bacteroides ovatus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | RRCAT INDUS-2 BEAMLINE PX-BL21 |
| Synchrotron site | RRCAT INDUS-2 |
| Beamline | PX-BL21 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2025-02-06 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.978930 |
| Spacegroup name | P 1 |
| Unit cell lengths | 68.653, 74.665, 86.751 |
| Unit cell angles | 72.86, 67.70, 64.78 |
Refinement procedure
| Resolution | 40.960 - 1.400 |
| R-factor | 0.1712 |
| Rwork | 0.170 |
| R-free | 0.19140 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.940 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21.2_5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.440 | 1.420 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Rmerge | 0.072 | 0.383 |
| Rmeas | 0.078 | 0.413 |
| Rpim | 0.029 | 0.153 |
| Number of reflections | 256392 | 7756 |
| <I/σ(I)> | 15.8 | 4 |
| Completeness [%] | 91.4 | 55.8 |
| Redundancy | 7 | 7.2 |
| CC(1/2) | 0.998 | 0.948 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 9.5 | 294 | 0.1 M CHES buffer, pH9.5, 20% PEG8000 |
