5A8Y
Crystal Structure of human neutrophil elastase in complex with a dihydropyrimidone inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER X8 PROTEUM |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | BRUKER |
Spacegroup name | P 63 |
Unit cell lengths | 73.025, 73.025, 69.842 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 36.510 - 1.900 |
R-factor | 0.16358 |
Rwork | 0.161 |
R-free | 0.22131 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
Data reduction software | SAINT |
Data scaling software | SADABS |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 36.510 |
High resolution limit [Å] | 1.900 |
Rmerge | 0.070 |
Number of reflections | 16760 |
<I/σ(I)> | 19.8 |
Completeness [%] | 99.9 |
Redundancy | 9.18 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |