7FOW
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P08E04 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 | 2020-05-03 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.999900 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 88.462, 82.250, 93.825 |
Unit cell angles | 90.00, 108.34, 90.00 |
Refinement procedure
Resolution | 44.530 - 1.510 |
R-factor | 0.1809 |
Rwork | 0.180 |
R-free | 0.21380 |
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] | 44.530 | 44.530 | 44.530 |
High resolution limit [Å] | 1.510 | 4.500 | 1.510 |
Rmerge | 0.046 | 2.213 | |
Rmeas | 0.064 | 0.050 | 2.392 |
Total number of observations | 689650 | 26164 | 105771 |
Number of reflections | 99596 | 3864 | 15540 |
<I/σ(I)> | 12.74 | 36.28 | 0.8 |
Completeness [%] | 98.7 | 99.1 | 95.6 |
Redundancy | 6.92 | 6.77 | 6.81 |
CC(1/2) | 0.998 | 0.997 | 0.413 |
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 |