3WEA
Crystal structure of a Niemann-Pick type C2 protein from Japanese carpenter ant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NW12A |
| Temperature [K] | 95 |
| Detector technology | CCD |
| Collection date | 2010-12-04 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 40.430, 35.652, 104.930 |
| Unit cell angles | 90.00, 92.33, 90.00 |
Refinement procedure
| Resolution | 22.420 - 1.800 |
| R-factor | 0.26181 |
| Rwork | 0.259 |
| R-free | 0.31671 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2hka |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.345 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 104.843 | 1.860 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Number of reflections | 28166 | |
| <I/σ(I)> | 7.1 | 3 |
| Completeness [%] | 99.0 | 98.1 |
| Redundancy | 5.9 | 4.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 25% (w/v) PEG 3350, 0.2mM sodium chloride, 0.1M HEPES buffer, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
