3WV5
Complex structure of VinN with 3-methylaspartate
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] | 100 |
| Detector technology | CCD |
| Collection date | 2013-12-17 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 1.0000 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 80.660, 109.410, 200.210 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.440 - 2.200 |
| R-factor | 0.20714 |
| Rwork | 0.205 |
| R-free | 0.24514 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3wv4 |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.748 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.440 | 2.280 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Number of reflections | 44288 | |
| Completeness [%] | 97.8 | 93.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 278 | 0.1M Tris-HCl, 0.2M sodium acetate, 30% polyethylene glycol 4000, 100mM DL-threo-beta-methylaspartate, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 278K |
