6DQR
Crystal structure of Haemophilus influenzae OppA complex with MGG
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-04-21 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 1.0781 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 47.574, 92.192, 108.366 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.750 - 2.080 |
R-factor | 0.1797 |
Rwork | 0.177 |
R-free | 0.23440 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.483 |
Data reduction software | XDS (Jan 26, 2018) |
Data scaling software | Aimless (0.6.3) |
Phasing software | BALBES (1.0.0) |
Refinement software | REFMAC (5.8.0218) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.750 | 2.140 |
High resolution limit [Å] | 2.080 | 2.080 |
Rmerge | 0.080 | 0.670 |
Number of reflections | 29098 | |
<I/σ(I)> | 15.6 | 3.1 |
Completeness [%] | 99.1 | 99.9 |
Redundancy | 11.1 | 11.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 295 | 0.1M sodium acetate pH 4.6, 2.5M ammonium sulfate |