4B2N
Latex Oxygenase RoxA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE X12 |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | X12 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 72.368, 97.106, 101.050 |
| Unit cell angles | 90.00, 98.39, 90.00 |
Refinement procedure
| Resolution | 35.800 - 1.800 |
| R-factor | 0.1707 |
| Rwork | 0.168 |
| R-free | 0.21960 |
| Structure solution method | MAD |
| RMSD bond length | 0.019 |
| RMSD bond angle | 2.726 |
| Data reduction software | HKL |
| Data scaling software | SCALEPACK |
| Phasing software | SHARP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.850 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.110 | 0.590 |
| Number of reflections | 126052 | |
| <I/σ(I)> | 10.4 | 2 |
| Completeness [%] | 98.6 | 97 |
| Redundancy | 5.1 | 4.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | PEG 8000, HEPES/NAOH PH 7.5 |
