3S7E
Crystal structure of Ara h 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-01-25 |
Detector | RIGAKU SATURN 92 |
Wavelength(s) | 1.5718 |
Spacegroup name | H 3 |
Unit cell lengths | 93.368, 93.368, 237.111 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 25.690 - 2.710 |
R-factor | 0.2376 |
Rwork | 0.236 |
R-free | 0.25968 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2ea7 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.328 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | HKL-3000 |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.750 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.053 | 0.159 |
Number of reflections | 19169 | |
<I/σ(I)> | 18.5 | 6.6 |
Completeness [%] | 92.1 | 64.8 |
Redundancy | 3.1 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 293 | 15% PEG400, 100 mM NaCl, Na citrate pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K |