6CKY
Crystal structure of UcmS2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 80 |
| Detector technology | CCD |
| Collection date | 2016-10-11 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97926 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 48.531, 75.945, 142.912 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 71.460 - 1.800 |
| R-factor | 0.21363 |
| Rwork | 0.211 |
| R-free | 0.26070 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5umw |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.954 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 71.460 | 1.830 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Number of reflections | 24648 | 1101 |
| <I/σ(I)> | 42 | 2.1 |
| Completeness [%] | 99.1 | 92.2 |
| Redundancy | 8.2 | 4.1 |
| CC(1/2) | 0.897 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M BIS-TRIS, pH 5.5, 25% w/v Polyethylene glycol 3,350 |
