3AQU
Crystal structure of a class V chitinase from Arabidopsis thaliana
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-17A |
Synchrotron site | Photon Factory |
Beamline | BL-17A |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2010-03-17 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.98 |
Spacegroup name | P 1 |
Unit cell lengths | 74.574, 75.079, 97.347 |
Unit cell angles | 73.63, 73.34, 68.47 |
Refinement procedure
Resolution | 50.000 - 2.010 |
R-factor | 0.1978 |
Rwork | 0.196 |
R-free | 0.22715 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3alf |
RMSD bond length | 0.009 |
RMSD bond angle | 1.155 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.030 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.336 | |
Number of reflections | 116512 | |
<I/σ(I)> | 7.6 | 1.9 |
Completeness [%] | 94.5 | 88.7 |
Redundancy | 2.9 | 2.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 293 | 100mM trisodium citrate, 20% PEG10000, pH 5.6, VAPOR DIFFUSION, SITTING DROP, temperature 293K |