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 |
