7FL9
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P05A08 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 | 2020-05-15 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.999900 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 89.542, 82.073, 93.796 |
Unit cell angles | 90.00, 108.35, 90.00 |
Refinement procedure
Resolution | 44.510 - 1.590 |
R-factor | 0.21 |
Rwork | 0.209 |
R-free | 0.23560 |
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] | 44.510 | 44.510 | 44.510 |
High resolution limit [Å] | 1.590 | 4.740 | 1.590 |
Rmerge | 0.032 | 2.617 | |
Rmeas | 0.062 | 0.035 | 2.830 |
Total number of observations | 598770 | 23144 | 94893 |
Number of reflections | 86553 | 3347 | 13881 |
<I/σ(I)> | 13.5 | 50.61 | 0.65 |
Completeness [%] | 99.7 | 99.5 | 99 |
Redundancy | 6.92 | 6.91 | 6.84 |
CC(1/2) | 0.999 | 0.999 | 0.324 |
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 |