7FO2
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P07G04 from the F2X-Universal Library
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX IV BEAMLINE BioMAX |
Synchrotron site | MAX IV |
Beamline | BioMAX |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-05-02 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.999900 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 89.383, 82.258, 93.875 |
Unit cell angles | 90.00, 108.08, 90.00 |
Refinement procedure
Resolution | 44.620 - 2.010 |
R-factor | 0.2432 |
Rwork | 0.241 |
R-free | 0.29430 |
Structure solution method | FOURIER SYNTHESIS |
Data reduction software | XDS (Jan 10, 2022) |
Data scaling software | Aimless |
Phasing software | PHENIX (1.17.1_3660) |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 44.620 | 44.620 | 44.620 |
High resolution limit [Å] | 2.010 | 5.970 | 2.010 |
Rmerge | 0.031 | 2.382 | |
Rmeas | 0.129 | 0.034 | 2.580 |
Total number of observations | 302536 | 11151 | 44676 |
Number of reflections | 42900 | 1689 | 6672 |
<I/σ(I)> | 11.47 | 51.15 | 0.69 |
Completeness [%] | 98.7 | 98.9 | 95.6 |
Redundancy | 7.05 | 6.6 | 6.7 |
CC(1/2) | 0.999 | 0.999 | 0.250 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 19% PEG4000, 3% DMSO, 0.1 M Tris, pH 8.5, 0.2 M lithium sulfate |