2PYB
Napa protein from borrelia burgdorferi
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 5.2R |
| Synchrotron site | ELETTRA |
| Beamline | 5.2R |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2002-11-15 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.2 |
| Spacegroup name | H 3 |
| Unit cell lengths | 93.078, 93.078, 227.500 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 37.990 - 2.600 |
| R-factor | 0.2419 |
| Rwork | 0.242 |
| R-free | 0.27540 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.800 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.760 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.075 | 0.388 |
| Number of reflections | 22533 | |
| <I/σ(I)> | 6.4 | 1.3 |
| Completeness [%] | 99.7 | 99.9 |
| Redundancy | 2.8 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 4.5 | 293 | 0.1M sodium acetate and 26-30% MPD, pH 4.5, VAPOR DIFFUSION, temperature 293K |
