7FP9
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P09A12 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 | 2020-07-03 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.999900 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 87.596, 81.898, 93.079 |
Unit cell angles | 90.00, 107.97, 90.00 |
Refinement procedure
Resolution | 44.270 - 1.900 |
R-factor | 0.2486 |
Rwork | 0.246 |
R-free | 0.30600 |
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] | 44.270 | 44.270 | 44.270 |
High resolution limit [Å] | 1.900 | 5.650 | 1.900 |
Rmerge | 0.037 | 3.144 | |
Rmeas | 0.088 | 0.040 | 3.413 |
Total number of observations | 336792 | 13102 | 51135 |
Number of reflections | 49417 | 1947 | 7725 |
<I/σ(I)> | 9.78 | 36.49 | 0.61 |
Completeness [%] | 99.3 | 99.5 | 96.4 |
Redundancy | 6.82 | 6.73 | 6.62 |
CC(1/2) | 0.999 | 0.998 | 0.380 |
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 |