5A8Z
Crystal Structure of human neutrophil elastase in complex with a dihydropyrimidone inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Detector | MARRESEARCH |
Spacegroup name | P 63 |
Unit cell lengths | 73.119, 73.119, 70.162 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 63.370 - 2.000 |
R-factor | 0.19224 |
Rwork | 0.190 |
R-free | 0.23644 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
RMSD bond length | 0.014 |
RMSD bond angle | 1.502 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 30.690 |
High resolution limit [Å] | 1.900 |
Rmerge | 0.100 |
Number of reflections | 16452 |
<I/σ(I)> | 6.4 |
Completeness [%] | 95.5 |
Redundancy | 8.71 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |