8PBS
Mutant K1482M of the dihydroorotase domain of human CAD protein in apo form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-12-22 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97926 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 80.252, 159.316, 60.822 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 46.370 - 2.050 |
| R-factor | 0.225 |
| Rwork | 0.224 |
| R-free | 0.24920 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.569 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER (v8.0) |
| Refinement software | REFMAC (v8.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.370 | 2.123 |
| High resolution limit [Å] | 2.050 | 2.050 |
| Number of reflections | 24841 | 2457 |
| <I/σ(I)> | 9.34 | 2.14 |
| Completeness [%] | 99.6 | |
| Redundancy | 6.4 | |
| CC(1/2) | 0.994 | 0.871 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 291 | 100 mM Tris-HCl pH 7, 2.5 M sodium formate |
