9BJV
Crystal structure of hypothetical protein PA5083 from Pseudomonas aeruginosa Sulfur SAD phased
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-002 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-07-16 |
Detector | DECTRIS PILATUS 200K |
Wavelength(s) | 1.5418 |
Spacegroup name | H 3 2 |
Unit cell lengths | 75.329, 75.329, 139.392 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 37.660 - 1.800 |
R-factor | 0.1741 |
Rwork | 0.172 |
R-free | 0.19160 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 0.821 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | AutoSol |
Refinement software | PHENIX (1.21) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.830 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.033 | 0.316 |
Rmeas | 0.034 | 0.350 |
Rpim | 0.008 | |
Number of reflections | 22679 | 686 |
<I/σ(I)> | 87.179 | 4.378 |
Completeness [%] | 97.3 | 77.3 |
Redundancy | 16.6 | 5.2 |
CC(1/2) | 0.947 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.1 M BIS-TRIS pH 5.5, 2.0 M Ammonium sulfate |