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 |
