4ZQG
Crystal structure of the Moraxella catarrhalis DOX-P Reductoisomerase in complex with NADH, fosmidomycin and magnesium
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-03-03 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9687 |
| Spacegroup name | P 65 |
| Unit cell lengths | 65.719, 65.719, 390.106 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 43.500 - 2.500 |
| R-factor | 0.19046 |
| Rwork | 0.188 |
| R-free | 0.23019 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.674 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 43.500 |
| High resolution limit [Å] | 2.500 |
| Number of reflections | 32902 |
| <I/σ(I)> | 11.4 |
| Completeness [%] | 100.0 |
| Redundancy | 16.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 291 | 0.1 M CHES pH 9.5, 20% (w/v) PEG 8000 |
