5U08
Crystal structure of an aminoglycoside acetyltransferase meta-AAC0020 from an uncultured soil metagenomic sample in complex with sisomicin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-G |
Synchrotron site | APS |
Beamline | 21-ID-G |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-07-07 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.978560 |
Spacegroup name | P 1 |
Unit cell lengths | 46.295, 53.035, 78.676 |
Unit cell angles | 71.76, 75.61, 88.69 |
Refinement procedure
Resolution | 19.547 - 1.520 |
R-factor | 0.1665 |
Rwork | 0.166 |
R-free | 0.19980 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5f46 |
RMSD bond length | 0.015 |
RMSD bond angle | 1.047 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX ((dev_2481: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.550 | 1.550 |
High resolution limit [Å] | 1.520 | 1.520 |
Rmerge | 0.067 | 1.301 |
Rpim | 0.538 | |
Number of reflections | 102238 | |
<I/σ(I)> | 22.3 | 2 |
Completeness [%] | 96.6 | 93.7 |
Redundancy | 15.6 | 13.3 |
CC(1/2) | 1.000 | 0.799 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298 | 20% PEG3350, 0.2 M calcium acetate, 20 mM sisomicin, soaked 24 hours in 20 mM sisomicin |