8TWJ
AvrB_R266A bound with UDP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-02-23 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.97918 |
Spacegroup name | P 65 |
Unit cell lengths | 119.830, 119.830, 63.906 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 40.280 - 1.900 |
R-factor | 0.1653 |
Rwork | 0.164 |
R-free | 0.19110 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.166 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.930 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.104 | |
Number of reflections | 41240 | 1180 |
<I/σ(I)> | 26.4 | |
Completeness [%] | 99.7 | |
Redundancy | 12.4 | |
CC(1/2) | 0.459 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277 | 100 mM Glycine (pH 8.9~9.5), 27%~34% PEG 550 MME |