8SD8
Carbonic anhydrase II radiation damage RT 91-120
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | FREE ELECTRON LASER |
Source details | PAL-XFEL BEAMLINE CSI |
Synchrotron site | PAL-XFEL |
Beamline | CSI |
Temperature [K] | 293 |
Detector technology | CCD |
Collection date | 2018-11-03 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9794 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 42.711, 41.535, 72.753 |
Unit cell angles | 90.00, 104.48, 90.00 |
Refinement procedure
Resolution | 24.791 - 1.789 |
R-factor | 0.137 |
Rwork | 0.136 |
R-free | 0.16000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ks3 |
RMSD bond length | 0.023 |
RMSD bond angle | 2.031 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.15.2_3472: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.830 |
High resolution limit [Å] | 1.789 | 1.789 |
Rmeas | 0.136 | 0.163 |
Number of reflections | 23198 | 2319 |
<I/σ(I)> | 14.48 | |
Completeness [%] | 99.2 | |
Redundancy | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 1.6 M sodium citrate, 50 mM Tris base |