6GX2
Blood group synthase AAGlyB in complex with UDP-GalNAc and cryoprotected with glycerol
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-09-07 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9762 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 52.569, 148.682, 79.677 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.000 - 1.070 |
| R-factor | 0.11288 |
| Rwork | 0.112 |
| R-free | 0.13385 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 3zgg |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.728 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.560 | 1.090 |
| High resolution limit [Å] | 1.070 | 1.070 |
| Number of reflections | 135972 | |
| <I/σ(I)> | 9.5 | |
| Completeness [%] | 99.2 | |
| Redundancy | 4.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | MOPS buffer, Magnesium chloride, ammonium sulfate and PEG3350 |
