7X87
The complex structure of beta-1,2-glucosyltransferase from Ignavibacterium album with sophotetraose observed as sophorose
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] | 100 |
| Detector technology | CCD |
| Collection date | 2017-04-15 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 165.135, 71.615, 130.308 |
| Unit cell angles | 90.00, 104.89, 90.00 |
Refinement procedure
| Resolution | 47.905 - 1.790 |
| Rwork | 0.166 |
| R-free | 0.20050 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7vkw |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.591 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.930 | 1.820 |
| High resolution limit [Å] | 1.790 | 1.790 |
| Number of reflections | 138455 | 6743 |
| <I/σ(I)> | 9.4 | 1.6 |
| Completeness [%] | 100.0 | 99.7 |
| Redundancy | 3.8 | 3.6 |
| CC(1/2) | 0.995 | 0.570 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 0.1M Tris-HCl (pH 7.5), 0.2M calcium acetate, 20%(w/v) PEG3350 |
