4DOL
Crystal structure of Arabidopsis thaliana fatty-acid binding protein At1g53520 (AtFAP3)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.2 |
Synchrotron site | ALS |
Beamline | 8.2.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-07-11 |
Detector | ADSC Quantum Q315 |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 51.908, 52.911, 95.563 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.274 - 1.700 |
Rwork | 0.203 |
R-free | 0.21970 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4doi |
RMSD bond length | 0.005 |
RMSD bond angle | 1.147 |
Data reduction software | MOSFLM |
Data scaling software | SCALA (3.2.21) |
Phasing software | MOLREP |
Refinement software | CNS |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 46.274 | 46.274 | 1.790 |
High resolution limit [Å] | 1.700 | 5.380 | 1.700 |
Rmerge | 0.045 | 0.026 | 0.575 |
Total number of observations | 6194 | 23634 | |
Number of reflections | 29609 | ||
<I/σ(I)> | 20.1 | 23.2 | 1.3 |
Completeness [%] | 99.7 | 93.1 | 99.3 |
Redundancy | 6.7 | 6.3 | 5.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 0.1 M sodium PIPES, 8% (w/v) PEG 8000, 0.2 M calcium acetate, 2 mM dithiothreitol, pH 6.5, vapor diffusion, hanging drop, temperature 277K |