8JU7
Structure of Pseudomonas aeruginosa ParS sensor domain
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-01-09 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.987 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 44.444, 31.594, 71.054 |
| Unit cell angles | 90.00, 100.03, 90.00 |
Refinement procedure
| Resolution | 25.270 - 1.800 |
| R-factor | 0.2036 |
| Rwork | 0.199 |
| R-free | 0.24220 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | AlphaFold |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.935 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.19.2_4158: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.830 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.106 | 0.704 |
| Rmeas | 0.115 | 0.768 |
| Rpim | 0.044 | 0.301 |
| Number of reflections | 17841 | 839 |
| <I/σ(I)> | 17.71 | 1.67 |
| Completeness [%] | 97.0 | |
| Redundancy | 6.7 | |
| CC(1/2) | 0.989 | 0.737 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 291 | 0.2 M Potassium sodium tartrate tetrahydrate, 0.1 M BIS-TRIS pH 6.5, 10% w/v Polyethylene glycol 10,000 |
