3QQI
Crystal structure of the HA1 receptor binding domain of H2 hemagglutinin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-B |
Synchrotron site | APS |
Beamline | 23-ID-B |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-06-05 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.97958 |
Spacegroup name | P 1 |
Unit cell lengths | 38.629, 62.318, 66.034 |
Unit cell angles | 64.25, 80.04, 72.12 |
Refinement procedure
Resolution | 36.720 - 1.650 |
R-factor | 0.201 |
Rwork | 0.199 |
R-free | 0.23350 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 1.120 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER (1.3.3) |
Refinement software | BUSTER-TNT |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.710 |
High resolution limit [Å] | 1.650 | 3.550 | 1.650 |
Rmerge | 0.053 | 0.037 | 0.244 |
Number of reflections | 60290 | ||
<I/σ(I)> | 12 | ||
Completeness [%] | 94.8 | 96.9 | 83.8 |
Redundancy | 1.9 | 1.9 | 1.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.1 | 295.5 | 1.25 Sodium Citrate, 0.1M HEPES, pH 8.1, vapor diffusion, sitting drop, temperature 295.5K |