8R1B
Crystal structure of recombinant LasB from Pseudomonas aeruginosa PAO1 in complex with 6466
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-11-03 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.8856 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 39.372, 89.982, 40.826 |
| Unit cell angles | 90.00, 114.08, 90.00 |
Refinement procedure
| Resolution | 44.990 - 1.310 |
| R-factor | 0.1464 |
| Rwork | 0.145 |
| R-free | 0.16720 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.313 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.991 | 1.333 |
| High resolution limit [Å] | 1.310 | 1.310 |
| Number of reflections | 433784 | 2988 |
| <I/σ(I)> | 11.3 | |
| Completeness [%] | 99.6 | |
| Redundancy | 5.9 | |
| CC(1/2) | 0.996 | 0.788 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 20 % (w/v) PEG 3350, 0.2 M Sodium thiocyanate |
