3GZ8
Cocrystal structure of NUDIX domain of Shewanella oneidensis NrtR complexed with ADP ribose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | OTHER |
| Collection date | 2008-11-14 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 63.046, 93.175, 132.497 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.100 - 2.430 |
| R-factor | 0.189 |
| Rwork | 0.186 |
| R-free | 0.24400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3gz5 |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.665 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.520 |
| High resolution limit [Å] | 2.430 | 5.230 | 2.430 |
| Rmerge | 0.050 | 0.026 | 0.274 |
| Number of reflections | 29833 | ||
| <I/σ(I)> | 27.391 | ||
| Completeness [%] | 99.0 | 96.5 | 97.6 |
| Redundancy | 4.6 | 4.7 | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
