2B5S
Crystal structure of peach Pru p3, the prototypic member of the family of plant non-specific lipid transfer protein pan-allergens
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-10-22 |
| Detector | SBC-2 |
| Wavelength(s) | 0.957 |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 102.352, 102.352, 74.236 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 44.320 - 2.350 |
| R-factor | 0.216 |
| Rwork | 0.216 |
| R-free | 0.26300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2alg |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.400 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.320 | 2.430 |
| High resolution limit [Å] | 2.350 | 2.350 |
| Rmerge | 0.077 | 0.660 |
| Number of reflections | 10082 | |
| <I/σ(I)> | 37.8 | 4.1 |
| Completeness [%] | 99.9 | 99.5 |
| Redundancy | 11.8 | 11 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | ammonium sulphate 2.3 M, Sodium acetate 0.1 M, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
