5EZ7
Crystal structure of the FAD dependent oxidoreductase PA4991 from Pseudomonas aeruginosa
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-04-12 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0093 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 37.890, 79.830, 63.230 |
| Unit cell angles | 90.00, 104.40, 90.00 |
Refinement procedure
| Resolution | 48.600 - 2.400 |
| R-factor | 0.17611 |
| Rwork | 0.173 |
| R-free | 0.22838 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | ab initio model from Rosetta |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.717 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 61.320 | 2.530 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.298 | |
| Number of reflections | 14372 | |
| <I/σ(I)> | 17.3 | 5.3 |
| Completeness [%] | 99.8 | 98.7 |
| Redundancy | 7.4 | 7.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 0.2 M trimethylamine N-oxide, 20% PEG2000 monomethyl-ether, 0.1 M Tris-HCl pH 8.5 |
