4RSY
Crystal structures of the Human leukotriene A4 Hydrolase complex with a potential inhibitor H7
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Wavelength(s) | 1 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 76.961, 86.803, 98.207 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 27.650 - 1.930 |
R-factor | 0.20085 |
Rwork | 0.198 |
R-free | 0.24801 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.018 |
RMSD bond angle | 1.812 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASES |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 27.650 | 1.982 |
High resolution limit [Å] | 1.930 | 1.932 |
Number of reflections | 47318 | |
Completeness [%] | 99.7 | 98.57 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 13% PEG 8000, 100mM Imidazole pH 6.0-6.8, 100mM Na Acetate, 5mM YbCl3, VAPOR DIFFUSION, HANGING DROP, temperature 293K |