8JVG
Crystal structure of dephospho-coenzyme A kinase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-1A |
| Synchrotron site | Photon Factory |
| Beamline | BL-1A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-12-12 |
| Detector | DECTRIS EIGER X 4M |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 61 |
| Unit cell lengths | 89.143, 89.143, 83.886 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 44.611 - 2.500 |
| Rwork | 0.206 |
| R-free | 0.27350 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.001 |
| RMSD bond angle | 0.474 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0411) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.611 | 2.600 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.052 | 0.383 |
| Rmeas | 0.053 | 0.392 |
| Rpim | 0.011 | 0.085 |
| Number of reflections | 13215 | 1489 |
| <I/σ(I)> | 42.1 | 8.8 |
| Completeness [%] | 100.0 | |
| Redundancy | 20.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | PEG 3350, coenzyme A, sodium malonate |
