3VJA
Crystal structure of the human squalene synthase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL13B1 |
Synchrotron site | NSRRC |
Beamline | BL13B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-07-25 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.00000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 52.008, 82.341, 77.175 |
Unit cell angles | 90.00, 91.57, 90.00 |
Refinement procedure
Resolution | 24.500 - 1.760 |
R-factor | 0.16838 |
Rwork | 0.165 |
R-free | 0.23304 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ezf |
RMSD bond length | 0.007 |
RMSD bond angle | 1.393 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.830 |
High resolution limit [Å] | 1.760 | 1.760 |
Rmerge | 0.061 | 0.489 |
Number of reflections | 62838 | |
<I/σ(I)> | 25.3 | 3.8 |
Completeness [%] | 98.3 | 97.8 |
Redundancy | 4.9 | 4.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | 20% PEG 2000 MME, 0.01M NiCl2, 0.1M Tris, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |