3B86
Crystal structure of T57S substituted LUSH protein complexed with ethanol
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 4.2.2 |
| Synchrotron site | ALS |
| Beamline | 4.2.2 |
| Detector technology | CCD |
| Detector | NOIR-1 |
| Wavelength(s) | 1.38 |
| Spacegroup name | P 43 |
| Unit cell lengths | 46.825, 46.825, 111.233 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.000 - 2.000 |
| R-factor | 0.219 |
| Rwork | 0.215 |
| R-free | 0.25800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.558 |
| Data reduction software | d*TREK |
| Data scaling software | d*TREK (9.3L) |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.110 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.068 | 0.396 |
| Total number of observations | 5014 | |
| Number of reflections | 16219 | |
| <I/σ(I)> | 10 | 2.8 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 3.62 | 3.09 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | VAPOR DIFFUSION, HANGING DROP |
