3R2R
1.65A resolution structure of Iron Soaked FtnA from Pseudomonas aeruginosa (pH 6.0)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2010-11-26 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.7401 |
| Spacegroup name | F 4 3 2 |
| Unit cell lengths | 170.729, 170.729, 170.729 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 60.362 - 1.650 |
| R-factor | 0.1567 |
| Rwork | 0.155 |
| R-free | 0.18260 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 3r2h |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.416 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Refinement software | PHENIX (1.6.4_486) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 98.570 | 1.740 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.122 | 0.588 |
| Number of reflections | 25503 | |
| <I/σ(I)> | 20.8081 | 2.02 |
| Completeness [%] | 97.3 | 81.21 |
| Redundancy | 29.22 | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6 | 293 | 35% (v/v) 2-methyl-2,4-pentanediol, 100 mM MES, 200 mM Li2SO4, pH 6.0, vapor diffusion, temperature 293K |
