4BRH
Legionella pneumophila NTPDase1 crystal form II (closed) in complex with MG AND THIAMINE PHOSPHOVANADATE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Temperature [K] | 100 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 62.435, 85.759, 72.306 |
| Unit cell angles | 90.00, 106.44, 90.00 |
Refinement procedure
| Resolution | 29.040 - 1.690 |
| R-factor | 0.15991 |
| Rwork | 0.159 |
| R-free | 0.19187 |
| Structure solution method | OTHER |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.955 |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 29.000 |
| High resolution limit [Å] | 1.690 |
| Rmerge | 0.040 |
| Number of reflections | 80289 |
| <I/σ(I)> | 34.3 |
| Completeness [%] | 98.8 |
| Redundancy | 7.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.6 | 100MM NAMES PH 5.6, 11% PEG3350, 20MM MGCL2 |
