4J38
Structure of Borrelia burgdorferi Outer surface protein E in complex with Factor H domains 19-20
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-06-25 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97372 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 86.405, 86.405, 107.784 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.509 - 2.830 |
R-factor | 0.1964 |
Rwork | 0.193 |
R-free | 0.25480 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2g7i |
RMSD bond length | 0.012 |
RMSD bond angle | 1.372 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | Rosetta |
Refinement software | PHENIX ((phenix.refine: 1.7.1_743)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.900 |
High resolution limit [Å] | 2.830 | 2.830 |
Rmerge | 0.170 | 1.098 |
Number of reflections | 12063 | |
<I/σ(I)> | 9.88 | 2.2 |
Completeness [%] | 99.2 | 95.2 |
Redundancy | 7.05 | 7.08 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 293 | 2M Ammonium sulfate, 0.1M Citric acid, 0.2M Sodium chloride, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |