8S34
Ferric-mycobactin receptor (FemA) in complex with aeruginic acid
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-02-23 |
| Detector | DECTRIS EIGER2 X 16M |
| Wavelength(s) | 0.95374 |
| Spacegroup name | P 1 |
| Unit cell lengths | 83.857, 84.878, 86.855 |
| Unit cell angles | 90.01, 118.53, 113.70 |
Refinement procedure
| Resolution | 75.470 - 1.860 |
| R-factor | 0.2151 |
| Rwork | 0.213 |
| R-free | 0.24890 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.944 |
| Data reduction software | xia2 |
| Data scaling software | DIALS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 75.470 | 1.890 |
| High resolution limit [Å] | 1.860 | 1.860 |
| Rmerge | 0.128 | |
| Number of reflections | 149305 | 4881 |
| <I/σ(I)> | 9.7 | |
| Completeness [%] | 94.6 | |
| Redundancy | 3.6 | |
| CC(1/2) | 0.995 | 0.282 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 293 | Peg 400, Hepes |
