9GCZ
XusB lipoprotein bound to ferric enterobactin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-03-04 |
| Detector | DECTRIS EIGER2 X CdTe 9M |
| Wavelength(s) | 0.6199 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 59.992, 48.180, 135.466 |
| Unit cell angles | 90.00, 96.79, 90.00 |
Refinement procedure
| Resolution | 38.050 - 1.500 |
| R-factor | 0.2057 |
| Rwork | 0.204 |
| R-free | 0.24390 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.825 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | PHENIX (1.21.1_5286) |
| Refinement software | PHENIX (1.21.1_5286) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.170 | 1.530 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rpim | 0.096 | 0.955 |
| Number of reflections | 122900 | 5684 |
| <I/σ(I)> | 6.7 | 1.4 |
| Completeness [%] | 99.6 | 99.4 |
| Redundancy | 6.7 | |
| CC(1/2) | 0.774 | 0.545 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 3.5 | 293 | 0.1M citric acid, 2M ammonium sulfate |
