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 |
