1W3R
NimA from D. radiodurans with Metronidazole and Pyruvate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 99.592, 39.166, 59.836 |
| Unit cell angles | 90.00, 114.09, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.900 |
| R-factor | 0.192 |
| Rwork | 0.189 |
| R-free | 0.25600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1w3o |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.476 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.2.0003) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | |
| High resolution limit [Å] | 1.900 | |
| Rmerge | 0.140 | 0.380 |
| Number of reflections | 16846 | |
| <I/σ(I)> | 9.3 | 2.9 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 4.3 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
