5M7B
Blood group synthase AAGlyB in complex with UDP 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 | 2015-07-03 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9762 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 52.624, 149.047, 79.733 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.000 - 1.500 |
R-factor | 0.14655 |
Rwork | 0.145 |
R-free | 0.17165 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 3zgg |
RMSD bond length | 0.013 |
RMSD bond angle | 1.620 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | REFMAC |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.130 | 1.530 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.069 | 0.649 |
Number of reflections | 50377 | |
<I/σ(I)> | 15.9 | |
Completeness [%] | 99.6 | 96.4 |
Redundancy | 5.3 | 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 |