5M7D
Blood group synthase AAGlyB in complex with UDP-Gal and cryoprotected with glycerol
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-08-28 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.0723 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 52.643, 148.796, 79.782 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.000 - 1.200 |
| R-factor | 0.13163 |
| Rwork | 0.130 |
| R-free | 0.15654 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.671 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.140 | 1.220 |
| High resolution limit [Å] | 1.200 | 1.200 |
| Rmerge | 0.088 | 0.522 |
| Number of reflections | 96982 | |
| <I/σ(I)> | 10.4 | 2.1 |
| Completeness [%] | 99.1 | 99.3 |
| Redundancy | 3.5 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | MOPS buffer, manganese chloride, ammonium sulfate, PEG 3350 |
