1HS6
STRUCTURE OF LEUKOTRIENE A4 HYDROLASE COMPLEXED WITH BESTATIN.
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | AREA DETECTOR |
| Collection date | 1998-07-12 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.992, 1.3838, 1.3842, 0.8856 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 67.600, 133.500, 83.400 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 25.000 - 1.950 |
| R-factor | 0.185 |
| Rwork | 0.188 |
| R-free | 0.24700 |
| Structure solution method | MAD |
| RMSD bond length | 0.010 |
| RMSD bond angle | 2.200 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MLPHARE |
| Refinement software | TNT |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.000 | 2.050 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.043 | 0.186 |
| Number of reflections | 54827 | |
| <I/σ(I)> | 6.59 | 3.9 |
| Completeness [%] | 97.7 | 89.6 |
| Redundancy | 4.7 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | liquid-liquid diffusion * | 6.8 | 298 | PEG8000, imidazole, sodium acetate, ytterbium chloride, bestatin, pH 6.8, LIQUID DIFFUSION, temperature 298K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | 1 | PEG8000 | 28 (%(w/v)) | |
| 2 | 1 | 1 | sodium acetate | 0.1 (mM) | |
| 3 | 1 | 1 | imidazole | 0.1 (mM) | |
| 4 | 1 | 1 | 5 (mM) | ||
| 5 | 1 | 2 | protein | 5 (mM) | |
| 6 | 1 | 2 | Tris-HCl | 10 (mM) | |
| 7 | 1 | 2 | bestatin | 1 (mM) |
