8VOG
UIC-12-BIF extension of UIC-1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-12-17 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.6199 |
Spacegroup name | P 1 |
Unit cell lengths | 10.240, 15.760, 31.197 |
Unit cell angles | 95.87, 97.00, 90.09 |
Refinement procedure
Resolution | 15.680 - 0.940 |
R-factor | 0.0799 |
Rwork | 0.079 |
R-free | 0.08980 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.801 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 15.680 | 0.974 |
High resolution limit [Å] | 0.940 | 0.940 |
Number of reflections | 11219 | 1138 |
<I/σ(I)> | 27.93 | |
Completeness [%] | 89.6 | |
Redundancy | 3.7 | |
CC(1/2) | 0.958 | 0.995 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | SLOW COOLING | 298 | Acetonitrile, water |