7FJV
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P03H10 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 | 2020-06-12 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.999900 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 88.571, 81.725, 93.587 |
Unit cell angles | 90.00, 108.28, 90.00 |
Refinement procedure
Resolution | 44.430 - 1.630 |
R-factor | 0.1986 |
Rwork | 0.197 |
R-free | 0.24010 |
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] | 44.430 | 44.430 | 44.430 |
High resolution limit [Å] | 1.630 | 4.850 | 1.630 |
Rmerge | 0.041 | 2.339 | |
Rmeas | 0.075 | 0.045 | 2.535 |
Total number of observations | 545954 | 21148 | 84994 |
Number of reflections | 79169 | 3091 | 12496 |
<I/σ(I)> | 11.96 | 42.24 | 0.64 |
Completeness [%] | 99.5 | 99.7 | 97.6 |
Redundancy | 6.9 | 6.84 | 6.8 |
CC(1/2) | 0.999 | 0.998 | 0.333 |
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 |