5INT
Crystal structure of the C-terminal Domain of Coenzyme A biosynthesis bifunctional protein CoaBC
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-12-22 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 4 21 2 |
| Unit cell lengths | 133.173, 133.173, 55.765 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 32.299 - 2.150 |
| R-factor | 0.2272 |
| Rwork | 0.226 |
| R-free | 0.25750 |
| Structure solution method | SAD |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.546 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | PHENIX (dev_1888) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 32.299 | 2.192 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.113 | |
| Number of reflections | 49614 | |
| <I/σ(I)> | 22 | |
| Completeness [%] | 99.9 | |
| Redundancy | 16.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 0.2 M Calcium Chloride 0.1 M Tris:HCl pH 8.5 25% (w/v) PEG 4000 |
