4QLX
Crystal structure of CLA-ER with product binding
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NE3A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NE3A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-06-20 |
| Detector | ADSC QUANTUM 270 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 64.933, 68.850, 197.497 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.902 - 1.950 |
| R-factor | 0.1895 |
| Rwork | 0.187 |
| R-free | 0.22970 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4qly |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.063 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.000 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Number of reflections | 32720 | |
| <I/σ(I)> | 11.93 | 2.49 |
| Completeness [%] | 99.7 | 80.6 |
| Redundancy | 7.08 | 6.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.8 | 293 | 100mM sodium cacodylate, 200mM NaCl, 2.0M ammonium sulfate, pH 6.8, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
