6G5Y
The X-ray structure of the adduct formed in the reaction between lysozyme and a platinum(II) terpyridine compound (acid pH)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-3 |
Synchrotron site | ESRF |
Beamline | MASSIF-3 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-10-22 |
Detector | DECTRIS PILATUS3 2M |
Wavelength(s) | 0.96771 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 78.490, 78.490, 36.730 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 55.500 - 1.490 |
R-factor | 0.19566 |
Rwork | 0.193 |
R-free | 0.24002 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.018 |
RMSD bond angle | 2.078 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 55.510 | 1.570 |
High resolution limit [Å] | 1.490 | 1.490 |
Rmerge | 0.039 | 0.514 |
Rpim | 0.025 | 0.219 |
Number of reflections | 18842 | |
<I/σ(I)> | 18.1 | 3.1 |
Completeness [%] | 98.3 | 100 |
Redundancy | 3.7 | 3.7 |
CC(1/2) | 1.000 | 0.672 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.4 | 283 | 20% ethylene glicol, 0.10 M sodium acetate pH 4.4, 0.60 M sodium nitrate |