3K9V
Crystal structure of rat mitochondrial P450 24A1 S57D in complex with CHAPS
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2008-03-27 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 0.97946 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 182.609, 81.647, 108.699 |
Unit cell angles | 90.00, 122.89, 90.00 |
Refinement procedure
Resolution | 30.000 - 2.500 |
R-factor | 0.20866 |
Rwork | 0.206 |
R-free | 0.25154 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1tqn |
RMSD bond length | 0.009 |
RMSD bond angle | 1.136 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 91.290 | 2.420 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.150 | 0.560 |
Number of reflections | 58240 | |
<I/σ(I)> | 15.6 | 4.1 |
Completeness [%] | 98.8 | 98.2 |
Redundancy | 10.1 | 8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 280 | 15% PEG 3350, 0.1M Tris-HCl, 0.2 M potassium thiocyanate, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 280K |