3LSM
Pyranose 2-oxidase H167A mutant with flavin N(5) sulfite adduct
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I911-2 |
Synchrotron site | MAX II |
Beamline | I911-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-06-20 |
Detector | MAR CCD 165 mm |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 101.568, 101.568, 249.577 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.200 - 1.700 |
R-factor | 0.16 |
Rwork | 0.160 |
R-free | 0.19500 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.025 |
RMSD bond angle | 2.066 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | FFT |
Refinement software | REFMAC (5.5.0066) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.200 | 1.800 |
High resolution limit [Å] | 1.700 | 1.700 |
Number of reflections | 143007 | |
<I/σ(I)> | 14.7 | 2.6 |
Completeness [%] | 99.5 | 99.1 |
Redundancy | 8.6 | 8.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.2 | 298 | 0.1M MES, 50mM MgCl2, 10% (w/v) monomethylether PEG 2000, pH 5.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K |