2PV9
Crystal structure of murine thrombin in complex with the extracellular fragment of murine PAR4
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-10-19 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.54 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 111.153, 111.153, 179.707 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 37.520 - 3.500 |
R-factor | 0.306 |
Rwork | 0.306 |
R-free | 0.31900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1shh |
RMSD bond length | 0.010 |
RMSD bond angle | 1.800 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP (from ccp4) |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 3.630 |
High resolution limit [Å] | 3.500 | 3.500 |
Rmerge | 0.110 | 0.328 |
Number of reflections | 8568 | |
<I/σ(I)> | 11.2 | 2.3 |
Completeness [%] | 97.1 | 86.3 |
Redundancy | 8.6 | 2.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.9 | 295 | 20% PEG 3350, 200 mM MgSO4, pH 5.9, VAPOR DIFFUSION, HANGING DROP, temperature 295K |