5W7S
Crystal structure of OxaC in complex with sinefungin and meleagrin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 23-ID-D |
Synchrotron site | APS |
Beamline | 23-ID-D |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-08-25 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.03 |
Spacegroup name | I 4 2 2 |
Unit cell lengths | 162.986, 162.986, 91.277 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.685 - 2.948 |
R-factor | 0.1983 |
Rwork | 0.195 |
R-free | 0.25900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5w7p |
RMSD bond length | 0.009 |
RMSD bond angle | 1.474 |
Data scaling software | XSCALE |
Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 46.685 |
High resolution limit [Å] | 2.948 |
Number of reflections | 15374 |
<I/σ(I)> | 14.25 |
Completeness [%] | 99.8 |
Redundancy | 14.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.6 | 293 | lithium sulfate, ammonium sulfate, sodium citrate, glycerol |