6Z3B
Low resolution structure of RgNanOx
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2019-04-08 |
Detector | DECTRIS EIGER2 XE 16M |
Wavelength(s) | 0.9795 |
Spacegroup name | I 41 2 2 |
Unit cell lengths | 150.100, 150.100, 193.310 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 118.560 - 2.580 |
R-factor | 0.21428 |
Rwork | 0.212 |
R-free | 0.24971 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5ui9 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.542 |
Data reduction software | Aimless |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 119.000 | 2.700 |
High resolution limit [Å] | 2.580 | 2.580 |
Number of reflections | 34401 | 1871 |
<I/σ(I)> | 7.5 | |
Completeness [%] | 98.6 | |
Redundancy | 7.5 | |
CC(1/2) | 1.000 | 1.000 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | PEG3000, sodium citrate |