3RYA
Lactococcal OppA complexed with SLSQLSSQS
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 70 |
| Detector technology | CCD |
| Collection date | 2011-02-11 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 41.628, 99.555, 123.910 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.400 - 2.900 |
| R-factor | 0.2261 |
| Rwork | 0.224 |
| R-free | 0.25700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3drf chain A |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.948 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER (2.1.4) |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 38.410 | 2.960 | |
| High resolution limit [Å] | 2.900 | 8.250 | 2.900 |
| Rmerge | 0.211 | 0.045 | 0.805 |
| Number of reflections | 11804 | 564 | 2011 |
| <I/σ(I)> | 8.2 | 26.16 | 2.06 |
| Completeness [%] | 98.3 | 95.4 | 95.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 0.2M NACL, 0.1M NA-HEPES, 20% PEG 6000, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
