6JFW
Crystal structure of PA0833 periplasmic domain from Pseudomonas aeruginosa reveals an unexpected enlarged peptidoglycan binding pocket
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-03-19 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.97923 |
| Spacegroup name | P 1 |
| Unit cell lengths | 28.436, 47.727, 99.691 |
| Unit cell angles | 89.98, 90.03, 90.04 |
Refinement procedure
| Resolution | 28.436 - 2.002 |
| R-factor | 0.1919 |
| Rwork | 0.190 |
| R-free | 0.22890 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2k1s |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.772 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Number of reflections | 34416 | |
| <I/σ(I)> | 13.043 | |
| Completeness [%] | 97.8 | |
| Redundancy | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.2M Ammonium sulfate, 0.1M Sodium acetate (pH 4.6), 25% w/v PEG 4000 |
