8C5N
Sub-atomic resolution structure of the chitin-binding protein D (CbpD) from Pseudomonas aeruginosa
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | MAX IV BEAMLINE BioMAX |
| Synchrotron site | MAX IV |
| Beamline | BioMAX |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-07-04 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.65255 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 31.600, 54.560, 47.980 |
| Unit cell angles | 90.00, 99.25, 90.00 |
Refinement procedure
| Resolution | 47.357 - 0.750 |
| Rwork | 0.154 |
| R-free | 0.16340 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.015 |
| RMSD bond angle | 2.072 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER (2.8.3) |
| Refinement software | SHELXL (2018/3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.400 | 0.760 |
| High resolution limit [Å] | 0.750 | 0.750 |
| Rmerge | 0.055 | |
| Rmeas | 0.056 | |
| Rpim | 0.012 | |
| Number of reflections | 198464 | 7613 |
| <I/σ(I)> | 20.9 | 0.6 |
| Completeness [%] | 97.0 | 76 |
| Redundancy | 19.9 | 8.3 |
| CC(1/2) | 0.999 | 0.300 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293.15 | 150 mM NaCl, 15 mM Tris-HCl pH 7.5, 0.2 M ammonium chloride, 20% PEG 3350 |
