6RJV
The X-ray structure of the Gold/Serum Albumin adduct obtained upon reaction of the protein with AuL12, a gold(III) dithiocarbamate complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-07-19 |
| Detector | DECTRIS EIGER X 4M |
| Wavelength(s) | 0.9677 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 214.380, 44.610, 142.610 |
| Unit cell angles | 90.00, 114.00, 90.00 |
Refinement procedure
| Resolution | 130.280 - 3.210 |
| R-factor | 0.19267 |
| Rwork | 0.190 |
| R-free | 0.25313 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3v03 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.682 |
| Data reduction software | XDS |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 130.280 | 3.260 |
| High resolution limit [Å] | 3.210 | 3.210 |
| Rmerge | 0.061 | 0.584 |
| Rpim | 0.041 | 0.377 |
| Number of reflections | 20541 | 985 |
| <I/σ(I)> | 13.3 | 2.2 |
| Completeness [%] | 98.6 | 99.7 |
| Redundancy | 3.1 | 3.3 |
| CC(1/2) | 0.999 | 0.689 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 20% PEG3350 0.1 M Tris HCl pH 8.5 0.2 M MgCl2 |
