7WCA
CATPO mutant - E484A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 291 |
| Detector technology | PIXEL |
| Collection date | 2015-05-18 |
| Detector | PSI JUNGFRAU 4M |
| Wavelength(s) | 0.97 |
| Spacegroup name | I 1 2 1 |
| Unit cell lengths | 124.790, 120.200, 184.076 |
| Unit cell angles | 90.00, 101.72, 90.00 |
Refinement procedure
| Resolution | 46.430 - 1.780 |
| R-factor | 0.1635 |
| Rwork | 0.162 |
| R-free | 0.20150 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4aum |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.609 |
| Data reduction software | XDS (3.27) |
| Data scaling software | XSCALE |
| Phasing software | MOLREP (11.7.03) |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.430 | 1.810 |
| High resolution limit [Å] | 1.780 | 1.780 |
| Rmerge | 0.084 | 0.084 |
| Number of reflections | 250722 | 250722 |
| <I/σ(I)> | 8 | |
| Completeness [%] | 98.8 | |
| Redundancy | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | PEG400, Potassium chloride, Calcium chloride, Sodium cacodylate |
