3QLM
Crystal structure of porcine pancreatic phospholipase A2 in complex with n-hexadecanoic acid
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2010-02-24 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.542 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 69.260, 69.260, 69.660 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 15.000 - 2.500 |
R-factor | 0.19411 |
Rwork | 0.191 |
R-free | 0.24935 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3o4m |
RMSD bond length | 0.019 |
RMSD bond angle | 1.898 |
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] | 45.440 | 2.740 |
High resolution limit [Å] | 2.500 | 2.600 |
Rmerge | 0.079 | |
Number of reflections | 6010 | |
Completeness [%] | 90.4 | 90.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | 294 | 15% MPD, 0.05M Tris Maliate, 5mM Calcium Chloride, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 294K |