3PMQ
Crystal structure of the outer membrane decaheme cytochrome MtrF
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-04-30 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.072 |
| Spacegroup name | I 2 3 |
| Unit cell lengths | 256.640, 256.640, 256.640 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.000 - 3.200 |
| R-factor | 0.3057 |
| Rwork | 0.305 |
| R-free | 0.32120 |
| Structure solution method | SAD |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.117 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | SHELXS |
| Refinement software | PHENIX ((phenix.refine: 1.6.4_486)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 3.370 |
| High resolution limit [Å] | 3.200 | 3.200 |
| Rmerge | 0.089 | 0.411 |
| Number of reflections | 45477 | |
| <I/σ(I)> | 9.6 | 1.8 |
| Completeness [%] | 100.0 | |
| Redundancy | 3.8 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 100 mM N-(2-Acetamido)iminodiacetate pH 6.5, 15 % ethylene glycol, 1.1 M ammonium phosphate, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
