6G5V
The X-ray structure of the adduct formed in the reaction between lysozyme and a platinum(II) terpyridine compound (pH 7.0)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-03-16 |
Detector | RIGAKU SATURN 944 |
Wavelength(s) | 1.5418 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 79.455, 79.455, 36.490 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 56.180 - 1.960 |
R-factor | 0.19093 |
Rwork | 0.188 |
R-free | 0.24993 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.016 |
RMSD bond angle | 1.817 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 56.180 | 1.990 |
High resolution limit [Å] | 1.960 | 1.960 |
Rmerge | 0.084 | 0.478 |
Rpim | 0.040 | 0.256 |
Number of reflections | 8823 | |
<I/σ(I)> | 8.1 | 3.1 |
Completeness [%] | 99.3 | 100 |
Redundancy | 2.8 | 2.4 |
CC(1/2) | 0.812 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 0.8 M succinic acid/NaOH, 0.10 M HEPES pH 7.0, 1% MPEG 2K |