3C5E
Crystal structure of human acyl-CoA synthetase medium-chain family member 2A (L64P mutation) in complex with ATP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-11-19 |
Detector | MARMOSAIC 325 mm CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 56.700, 98.073, 120.263 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.000 - 1.600 |
R-factor | 0.15806 |
Rwork | 0.156 |
R-free | 0.19423 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3b7w |
RMSD bond length | 0.017 |
RMSD bond angle | 1.653 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.4.0066) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 51.300 | 1.690 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.071 | 0.594 |
Number of reflections | 84181 | |
<I/σ(I)> | 11.6 | 2 |
Completeness [%] | 99.5 | 97 |
Redundancy | 3.6 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.5 | 293 | 17% PEG 10000, 0.1M Ammonium acetate, 0.1M Bis-Tris pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |