6HAF
Pyruvate oxidase variant E59Q from L. plantarum in complex with phosphate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1) |
Synchrotron site | PETRA III, EMBL c/o DESY |
Beamline | P13 (MX1) |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-05-20 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.82656 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 119.180, 154.350, 165.520 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.359 - 1.300 |
R-factor | 0.1353 |
Rwork | 0.134 |
R-free | 0.15600 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.483 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 48.359 | 50.000 | 1.400 |
High resolution limit [Å] | 1.300 | 48.359 | 1.300 |
Rmerge | 0.094 | 0.696 | |
Rmeas | 0.106 | 0.783 | |
Number of reflections | 369535 | 73234 | |
<I/σ(I)> | 10.09 | 2.12 | |
Completeness [%] | 99.8 | 99.9 | |
Redundancy | 4.746 | 4.784 | |
CC(1/2) | 0.998 | 0.742 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 280 | 1.5 M ammonium sulfate, 200 mM phosphate, 0.1 mM thiamine diphosphate, 1 mM magnesium chloride |