6AOY
F9 pilus adhesin FmlH lectin domain from E. coli UTI89 co-crystallized with o-nitrophenyl beta-galactoside (ONPG)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2014-11-24 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 66.220, 78.320, 58.520 |
Unit cell angles | 90.00, 97.45, 90.00 |
Refinement procedure
Resolution | 32.830 - 1.800 |
R-factor | 0.1869 |
Rwork | 0.185 |
R-free | 0.22040 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6aow |
RMSD bond length | 0.003 |
RMSD bond angle | 0.870 |
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] | 40.030 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.081 | 0.678 |
Rmeas | 0.087 | 0.754 |
Rpim | 0.032 | 0.322 |
Number of reflections | 27380 | 3937 |
<I/σ(I)> | 15.6 | 2.8 |
Completeness [%] | 99.6 | 98.5 |
Redundancy | 6.9 | 5.1 |
CC(1/2) | 0.999 | 0.788 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 293 | 0.2 M ammonium sulfate, 0.1M NaCl, 0.1 M MES pH 5.6, 32% PEG 3350 |