5YHG
The crystal structure of Staphylococcus aureus CntA in complex with staphylopine and zinc
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 77 |
| Detector technology | PIXEL |
| Collection date | 2017-03-15 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9778 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 86.070, 156.349, 42.257 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 78.300 - 2.030 |
| R-factor | 0.16175 |
| Rwork | 0.159 |
| R-free | 0.21312 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.906 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 78.300 |
| High resolution limit [Å] | 2.030 |
| Number of reflections | 37675 |
| <I/σ(I)> | 24.9 |
| Completeness [%] | 99.7 |
| Redundancy | 12.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 287 | 0.1M BICINE pH 8.5, 8%(w/v) Polyethylene glycol monomethyl ether 5000 |
