8JF9
Crystal structure of 3-oxoacyl-ACP reductase FabG from Helicobacter pylori
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-05-13 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9875 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 70.770, 113.925, 129.858 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.740 - 1.900 |
| R-factor | 0.1796 |
| Rwork | 0.177 |
| R-free | 0.22040 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6uut |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.162 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.18.2_3874: ???)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.970 |
| High resolution limit [Å] | 1.900 | 4.090 | 1.900 |
| Rmerge | 0.240 | 0.088 | 2.395 |
| Rmeas | 0.250 | 0.092 | 2.494 |
| Rpim | 0.069 | 0.026 | 0.692 |
| Total number of observations | 1058084 | ||
| Number of reflections | 82455 | 8592 | 8172 |
| <I/σ(I)> | 3.6 | ||
| Completeness [%] | 99.7 | 99 | 100 |
| Redundancy | 12.8 | 12.6 | 12.5 |
| CC(1/2) | 0.994 | 0.989 | 0.719 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.1 M NaCl, 15% w/v PEG 6000 |
