4GAA
Structure of Leukotriene A4 hydrolase from Xenopus laevis complexed with inhibitor bestatin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-06-23 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.939 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 222.120, 52.170, 109.900 |
| Unit cell angles | 90.00, 111.58, 90.00 |
Refinement procedure
| Resolution | 29.300 - 2.260 |
| R-factor | 0.2232 |
| Rwork | 0.222 |
| R-free | 0.24980 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.040 |
| Data reduction software | PROCESS |
| Data scaling software | PROCESS |
| Phasing software | MOLREP |
| Refinement software | BUSTER (2.11.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.304 | 2.268 |
| High resolution limit [Å] | 2.260 | 2.261 |
| Rmerge | 0.072 | 0.531 |
| Number of reflections | 54861 | |
| <I/σ(I)> | 12.7 | 2.9 |
| Completeness [%] | 99.1 | 99.6 |
| Redundancy | 4 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 295 | 0.1 M Bis-Tris, 20 % PEG 3350, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
