3UU2
Salmonella typhi osmoporin(OmpC):an Outer Membrane Protein
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 77.03 |
| Detector technology | CCD |
| Collection date | 2010-05-04 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0048 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 182.201, 108.568, 113.391 |
| Unit cell angles | 90.00, 117.83, 90.00 |
Refinement procedure
| Resolution | 50.000 - 3.590 |
| R-factor | 0.3049 |
| Rwork | 0.302 |
| R-free | 0.35808 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3upg |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.471 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 100.270 | 3.670 |
| High resolution limit [Å] | 3.330 | 3.590 |
| Rmerge | 0.110 | 0.526 |
| Number of reflections | 27261 | |
| <I/σ(I)> | 23 | 2.95 |
| Completeness [%] | 95.7 | 93.2 |
| Redundancy | 12.1 | 9.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Microbatch under oil | 8.5 | 298.15 | 0.01M Nickel(II) chloride hexahydrate, 0.1M Tris, 20% PEG MME 2000, pH 8.5, Microbatch under oil, temperature 298.15K |
