2WTX
Insight into the mechanism of enzymatic glycosyltransfer with retention through the synthesis and analysis of bisubstrate glycomimetics of trehalose-6-phosphate synthase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-1 |
Synchrotron site | ESRF |
Beamline | ID14-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 104.515, 120.287, 173.786 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 98.910 - 2.200 |
R-factor | 0.19698 |
Rwork | 0.195 |
R-free | 0.23473 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1gz5 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.432 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 99.000 | 2.300 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.100 | 0.340 |
Number of reflections | 111567 | |
<I/σ(I)> | 14 | 5 |
Completeness [%] | 99.9 | 99.4 |
Redundancy | 5.2 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |