6U87
Pseudomonas aeruginosa HasA mutant - Y75H
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 291 |
Detector technology | CCD |
Collection date | 2019-07-25 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 34.656, 47.035, 101.239 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.456 - 1.300 |
R-factor | 0.1669 |
Rwork | 0.166 |
R-free | 0.17760 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ell |
RMSD bond length | 0.006 |
RMSD bond angle | 0.874 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHENIX |
Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.456 | 1.390 |
High resolution limit [Å] | 1.300 | 1.320 |
Number of reflections | 40083 | 116 |
<I/σ(I)> | 6.9 | |
Completeness [%] | 96.4 | |
Redundancy | 14.7 | |
CC(1/2) | 0.957 | 0.957 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.1M NaCl, 0.1M HEPES pH 7.5, 1.6M Ammonium Sulfate |