5JQI
Crystal structure of FimH A62S from E. coli UTI89 bound to FimG N-terminal extension
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2016-02-21 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.54179 |
Spacegroup name | P 1 |
Unit cell lengths | 56.440, 75.560, 78.440 |
Unit cell angles | 68.35, 69.00, 77.43 |
Refinement procedure
Resolution | 48.666 - 1.962 |
R-factor | 0.1913 |
Rwork | 0.189 |
R-free | 0.23940 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3jwn |
RMSD bond length | 0.004 |
RMSD bond angle | 0.790 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.670 | 2.030 |
High resolution limit [Å] | 1.960 | 1.960 |
Rmerge | 0.141 | 0.706 |
Number of reflections | 75411 | |
<I/σ(I)> | 8.5 | 2 |
Completeness [%] | 94.2 | 90.4 |
Redundancy | 3.9 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.2 M Calcium Acetate, 0.1 M HEPES 7.5, 10% PEG 8000 |