8UAI
Crystal structure of hetero hexameric hazelnut allergen Cor a 9
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 110 |
Detector technology | CCD |
Collection date | 2007-12-05 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 149.168, 91.093, 74.854 |
Unit cell angles | 90.00, 90.32, 90.00 |
Refinement procedure
Resolution | 45.800 - 1.920 |
R-factor | 0.176 |
Rwork | 0.174 |
R-free | 0.22120 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 0.987 |
Data reduction software | HKL-2000 (v722) |
Data scaling software | HKL-2000 (v722) |
Phasing software | PHASER (2.8.3) |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.960 |
High resolution limit [Å] | 1.920 | 1.920 |
Rmeas | 0.111 | 0.661 |
Rpim | 0.063 | 0.381 |
Number of reflections | 142012 | 7049 |
<I/σ(I)> | 10 | 1.66 |
Completeness [%] | 94.5 | 93.2 |
Redundancy | 2.6 | 2.5 |
CC(1/2) | 0.984 | 0.725 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 277 | Protein drops: 5 mM Tris pH 8.0, 0.M M NaCl. Well solution: 0.2M NaCl |