4BRA
Legionella pneumophila NTPDase1 crystal form II, closed, Mg AMPPNP complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.2 |
| Synchrotron site | BESSY |
| Beamline | 14.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | MARMOSAIC 225 mm CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 61.448, 85.204, 70.736 |
| Unit cell angles | 90.00, 108.34, 90.00 |
Refinement procedure
| Resolution | 29.180 - 1.600 |
| R-factor | 0.12443 |
| Rwork | 0.123 |
| R-free | 0.18858 |
| Structure solution method | OTHER |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.021 |
| RMSD bond angle | 1.982 |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 29.000 |
| High resolution limit [Å] | 1.600 |
| Rmerge | 0.070 |
| Number of reflections | 91380 |
| <I/σ(I)> | 7.7 |
| Completeness [%] | 99.2 |
| Redundancy | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.5 | 100MM NAMES PH 5.5, 15% PEG3350 |
