5FWR
Breaking down the wall: mutation of the tyrosine gate of the universal Escherichia coli fimbrial adhesin FimH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.2 |
| Synchrotron site | BESSY |
| Beamline | 14.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-04-19 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 |
| Unit cell lengths | 53.015, 74.005, 111.768 |
| Unit cell angles | 99.32, 102.97, 97.83 |
Refinement procedure
| Resolution | 47.627 - 2.130 |
| R-factor | 0.2303 |
| Rwork | 0.225 |
| R-free | 0.33180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4auu |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.280 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.630 | 2.260 |
| High resolution limit [Å] | 2.130 | 2.130 |
| Rmerge | 0.150 | 0.480 |
| Number of reflections | 85074 | |
| <I/σ(I)> | 6.13 | 2.57 |
| Completeness [%] | 94.5 | 81.9 |
| Redundancy | 2.32 | 2.32 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.8 | 5% W/V PGA-LM 100 MM TRIS PH 7.8 ; 20% W/V PEG 3350 ; 5 MM 4-BIPHENYL ALPHA-D-MANNOPYRANOSIDE |
