3ECY
Crystal structural analysis of Drosophila melanogaster dUTPase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE BW7B |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | BW7B |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 0.8457 |
| Spacegroup name | P 41 |
| Unit cell lengths | 42.799, 42.799, 169.384 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.880 |
| R-factor | 0.20152 |
| Rwork | 0.200 |
| R-free | 0.22221 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1q5u |
| RMSD bond length | 0.021 |
| RMSD bond angle | 1.938 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.890 |
| High resolution limit [Å] | 1.780 | 1.780 |
| Number of reflections | 28229 | |
| <I/σ(I)> | 14.95 | 2.3 |
| Completeness [%] | 99.1 | 95.6 |
| Redundancy | 7.45 | 6.84 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 297 | 50 mM sodium succinate buffer, 200 mM sodium chloride, 30-35% methyl-pentane diol, pH 4.6, VAPOR DIFFUSION, SITTING DROP, temperature 297K |
