4YLT
Crystal structure of beta-ketoacyl-ACP synthase III (FabH) from Yersinia pestis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-08-31 |
Detector | ADSC QUANTUM 210r |
Wavelength(s) | 0.9786 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 91.354, 120.017, 49.304 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.095 - 2.200 |
R-factor | 0.1743 |
Rwork | 0.172 |
R-free | 0.22070 |
RMSD bond length | 0.005 |
RMSD bond angle | 0.849 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: dev_1834)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.800 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.065 | 0.272 |
Number of reflections | 13314 | |
<I/σ(I)> | 17.9 | 5.1 |
Completeness [%] | 94.5 | 70.4 |
Redundancy | 6.7 | 4.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 296.15 | 10% Propan-2-ol, 0.1 M HEPES sodium salt pH 7.5, 15% Glycerol, and 24% PEG4000 |