6MOD
Co-Crystal structure of P. aeruginosa LpxC-50432 complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-F |
Synchrotron site | APS |
Beamline | 21-ID-F |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-11-09 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 36.079, 66.911, 63.462 |
Unit cell angles | 90.00, 91.08, 90.00 |
Refinement procedure
Resolution | 63.450 - 1.850 |
R-factor | 0.18699 |
Rwork | 0.184 |
R-free | 0.23879 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.594 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 63.450 | 1.900 |
High resolution limit [Å] | 1.850 | 1.850 |
Number of reflections | 23995 | |
<I/σ(I)> | 8.17 | |
Completeness [%] | 98.3 | |
Redundancy | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 50 mM MgCl2, 22.5% PEG 3350 and 0.1 M HEPES pH 7.5 |