8RTJ
X-ray structure of lysozyme obtained upon reaction with [VIVO(8-HQ)2] in ethylene glycol
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 5.2R |
| Synchrotron site | ELETTRA |
| Beamline | 5.2R |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-07-13 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.00 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 78.140, 78.140, 37.520 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 55.236 - 1.270 |
| Rwork | 0.174 |
| R-free | 0.19680 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.015 |
| RMSD bond angle | 2.010 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 55.250 | 1.300 |
| High resolution limit [Å] | 1.270 | 1.270 |
| Rmerge | 1.629 | |
| Number of reflections | 31889 | 1522 |
| <I/σ(I)> | 36.5 | |
| Completeness [%] | 99.9 | |
| Redundancy | 23.7 | |
| CC(1/2) | 1.000 | 0.844 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 293 | 20% ethylene glycol, 0.6 M sodium nitrate, 0.1 M sodium acetate at pH 4.5 |
