4Z3M
X-ray structure of the adduct formed in the reaction between lysozyme and a platinum(II) Complex with S,O Bidentate Ligands (9b)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-11-17 |
| Detector | RIGAKU SATURN 944+ |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 78.261, 78.261, 36.878 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 55.340 - 2.150 |
| R-factor | 0.16354 |
| Rwork | 0.160 |
| R-free | 0.23267 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4j4t |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.793 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 55.340 | 2.200 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.135 | 0.440 |
| Number of reflections | 6498 | |
| <I/σ(I)> | 11 | 2.9 |
| Completeness [%] | 97.9 | 99.2 |
| Redundancy | 6.7 | 6.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 298 | 20% ethylene glycol, 0.1 M sodium acetate pH 4.5, 0.6 M sodium nitrate |
