8I07
Crystal structure of Escherichia coli glyoxylate carboligase double mutant in complex with glycolaldehyde
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 11C |
Synchrotron site | PAL/PLS |
Beamline | 11C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-06-28 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9794 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 189.299, 189.299, 246.982 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.890 - 1.990 |
R-factor | 0.2088 |
Rwork | 0.208 |
R-free | 0.24220 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 0.903 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (v2.0) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.020 |
High resolution limit [Å] | 1.990 | 5.400 | 1.990 |
Rmerge | 0.998 | 0.062 | 1.837 |
Total number of observations | 6178989 | ||
Number of reflections | 302448 | 29426 | 29063 |
<I/σ(I)> | 2.5 | ||
Completeness [%] | 99.7 | 100 | 99.2 |
Redundancy | 10.6 | 13.6 | 9.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 10 mM Tris-HCl (pH 8.0), 0.5 M sodium chloride, 40 mM dithiothreitol, 0.5% (v/v) polyethylene glycol 6000 (PEG6K) |