4F07
Structure of the Styrene Monooxygenase Flavin Reductase (SMOB) from Pseudomonas putida S12
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-09-29 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 32 |
| Unit cell lengths | 130.031, 130.031, 95.270 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.470 - 2.300 |
| R-factor | 0.188 |
| Rwork | 0.185 |
| R-free | 0.24800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1rz0 |
| RMSD bond length | 0.023 |
| RMSD bond angle | 1.962 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.270 |
| High resolution limit [Å] | 2.230 | 2.230 |
| Number of reflections | 87338 | |
| <I/σ(I)> | 13.4 | |
| Completeness [%] | 99.9 | 99 |
| Redundancy | 6 | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | 100 mM Tris, 8.5, 1.7-1.9 M (NH4)2SO4, 200-300 mM NH4NO3, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
