3M6S
Crystal structure of H1N1pdm Hemagglutinin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-BM |
| Synchrotron site | APS |
| Beamline | 22-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-02-10 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 |
| Unit cell lengths | 73.984, 109.709, 129.896 |
| Unit cell angles | 86.25, 74.68, 75.10 |
Refinement procedure
| Resolution | 50.000 - 2.800 |
| R-factor | 0.23109 |
| Rwork | 0.230 |
| R-free | 0.25588 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ku3 |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.701 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.900 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Number of reflections | 94645 | |
| <I/σ(I)> | 1.6 | |
| Completeness [%] | 98.1 | 95.7 |
| Redundancy | 2 | 1.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | microbatch under oil | 7.5 | 293 | 22% PEG2000MME, 0.1M HEPES at pH7.5, microbatch under oil, temperature 293K |
