6E55
1.57 Angstroem Crystal Structure of FeoA from Klebsiella pneumoniae
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-11-05 |
| Detector | RAYONIX MX-300 |
| Wavelength(s) | 0.97856 |
| Spacegroup name | P 31 |
| Unit cell lengths | 79.010, 79.010, 74.660 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 31.100 - 1.570 |
| Rwork | 0.174 |
| R-free | 0.19300 |
| Structure solution method | SAD |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.068 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.330 | 1.600 |
| High resolution limit [Å] | 1.570 | 1.570 |
| Rmerge | 0.067 | |
| Number of reflections | 72562 | 7267 |
| <I/σ(I)> | 15.7 | 1.3 |
| Completeness [%] | 99.2 | 99.45 |
| Redundancy | 7 | 1.3 |
| CC(1/2) | 1.000 | 0.469 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 293 | 2.0 M ammonium sulfate, 0.1 M ammonium fluoride, 3% glycerol |
