6P80
Structure of E. coli MS115-1 CdnC + ATP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-04-19 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 76.184, 76.184, 100.498 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 19.227 - 1.500 |
| R-factor | 0.1569 |
| Rwork | 0.155 |
| R-free | 0.18890 |
| Structure solution method | SAD |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.146 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.15.2_3472: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.230 | 1.460 |
| High resolution limit [Å] | 1.440 | 1.440 |
| Rmerge | 0.029 | 1.429 |
| Rmeas | 0.034 | 1.776 |
| Rpim | 0.019 | 1.040 |
| Number of reflections | 60488 | 2932 |
| <I/σ(I)> | 15 | 0.6 |
| Completeness [%] | 98.6 | 96.8 |
| Redundancy | 3 | 2.7 |
| CC(1/2) | 1.000 | 0.263 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.1 | 293 | 20 mM HEPES pH 8.1, 10-12% PEG 4000, 100 mM NaCl, 10 mM MgCl2 |
