4N4O
Nitrosomonas europea HAO soaked in NH2OH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-12-15 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.9778 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 140.090, 141.960, 106.480 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.950 - 2.472 |
| R-factor | 0.22859 |
| Rwork | 0.224 |
| R-free | 0.27289 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 4n4n |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.917 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | REFMAC (5.5.010) |
| Refinement software | REFMAC (5.5.010) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.700 |
| High resolution limit [Å] | 2.472 | 2.472 |
| Rmerge | 0.124 | 0.541 |
| Number of reflections | 68039 | |
| <I/σ(I)> | 11 | 3.1 |
| Completeness [%] | 99.3 | 99.3 |
| Redundancy | 4.5 | 4.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH UNDER OIL | 7.5 | 293 | 42% v/v PEG400, 50 mM potassium nitrate, 100 mM MES/NaOH, pH 7.5, MICROBATCH UNDER OIL, temperature 293K |
