6G5C
Interaction of TiO2 nanoparticles (NM-101) with Lysozyme
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | Agilent SuperNova |
Temperature [K] | 130 |
Detector technology | CCD |
Collection date | 2018-03-01 |
Detector | AGILENT ATLAS CCD |
Wavelength(s) | 1.8 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 78.866, 78.866, 36.893 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 14.500 - 1.800 |
R-factor | 0.16733 |
Rwork | 0.166 |
R-free | 0.20418 |
RMSD bond length | 0.019 |
RMSD bond angle | 1.855 |
Data reduction software | CrysalisPro |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 14.500 | 4.800 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.060 | |
Number of reflections | 10691 | |
<I/σ(I)> | 11.1 | |
Completeness [%] | 99.7 | |
Redundancy | 7.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 296 | 20 mg/ml Lys in TiO2 2.56 mg/ml (JRC NM-101 ) Well/solution 10% (w/v) sodium chloride 0.1 M Sodium acetate buffer pH 5.0 25% (v/v) ethylene glycol drop 4 microliter Lys + 2 microliter TiO2 |