8GJ5
fungal pcna and peptidomimetic
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-02-17 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9537 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 83.929, 96.976, 108.054 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.200 - 2.300 |
R-factor | 0.2396 |
Rwork | 0.239 |
R-free | 0.25120 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.004 |
RMSD bond angle | 0.922 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX ((1.18.2_3874: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.490 | 2.390 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.100 | 2.017 |
Rmeas | 0.104 | 2.101 |
Rpim | 0.028 | 0.580 |
Total number of observations | 540450 | 51539 |
Number of reflections | 39804 | 4085 |
<I/σ(I)> | 20.1 | 1.4 |
Completeness [%] | 99.9 | |
Redundancy | 13.6 | 12.6 |
CC(1/2) | 1.000 | 0.616 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289.15 | 0.2M Tacsimate pH 4.0 0.1M Na Acetate, 16% PEG 3350 tray |