4BRF
Legionella pneumophila NTPDase1 crystal form II (closed) in complex with a distorted orthomolybdate ion and AMP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Temperature [K] | 100 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 62.144, 85.970, 71.888 |
| Unit cell angles | 90.00, 106.14, 90.00 |
Refinement procedure
| Resolution | 29.870 - 1.600 |
| R-factor | 0.12631 |
| Rwork | 0.125 |
| R-free | 0.18430 |
| Structure solution method | OTHER |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.839 |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 30.000 |
| High resolution limit [Å] | 1.600 |
| Rmerge | 0.070 |
| Number of reflections | 93825 |
| <I/σ(I)> | 13.4 |
| Completeness [%] | 98.0 |
| Redundancy | 5.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.4 | 100MM NA+ MES PH 5.4, 100MM NACL, 14% PEG3350, 20MM MGCL2, 50MM MGSO4 |
