3JTI
Crystal structure of the complex formed between Phospholipase A2 with beta-amyloid fragment, Lys-Gly-Ala-Ile-Ile-Gly-Leu-Met at 1.8 A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU300 |
Temperature [K] | 298 |
Detector technology | IMAGE PLATE |
Collection date | 2008-04-19 |
Detector | MARRESEARCH |
Wavelength(s) | 1.5418 |
Spacegroup name | P 41 |
Unit cell lengths | 42.762, 42.762, 65.765 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.850 - 1.800 |
R-factor | 0.17291 |
Rwork | 0.171 |
R-free | 0.21019 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3gci |
RMSD bond length | 0.024 |
RMSD bond angle | 1.980 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.800 | 1.800 |
High resolution limit [Å] | 1.800 | 1.760 |
Number of reflections | 10374 | |
<I/σ(I)> | 14.4 | 3 |
Completeness [%] | 98.4 | 96.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 290 | 10MM SODIUM PHOSPHATE, 1mM CACL2, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 290K |