8VP7
UIC-13-BIF-A4(Dab) 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 | 2023-04-07 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.6199 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 23.940, 19.311, 48.032 |
Unit cell angles | 90.00, 98.76, 90.00 |
Refinement procedure
Resolution | 22.590 - 1.480 |
R-factor | 0.1543 |
Rwork | 0.151 |
R-free | 0.20630 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.560 |
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] | 22.590 | 1.533 |
High resolution limit [Å] | 1.480 | 1.480 |
Number of reflections | 7403 | 727 |
<I/σ(I)> | 8.98 | |
Completeness [%] | 98.6 | |
Redundancy | 6.5 | |
CC(1/2) | 0.997 | 0.674 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | SLOW COOLING | 298 | Acetonitrile, water |