4BJU
Genetic and structural validation of Aspergillus fumigatus N- acetylphosphoglucosamine mutase as an antifungal target
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-08-25 |
| Detector | MARMOSAIC 225 mm CCD |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 74.700, 86.570, 185.420 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 24.690 - 2.350 |
| R-factor | 0.21965 |
| Rwork | 0.218 |
| R-free | 0.27691 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2dka |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.363 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALEPACK |
| Phasing software | CCP4I |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | |
| High resolution limit [Å] | 2.350 | 2.350 |
| Rmerge | 0.060 | |
| Number of reflections | 50913 | |
| <I/σ(I)> | 34.7 | 1.8 |
| Completeness [%] | 99.8 | |
| Redundancy | 3.5 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.25 | pH 7.25 |
