6V4V
The crystal structure of BonA from Acinetobacter baumannii
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 | 2016-03-17 |
| Detector | MAR CCD 130 mm |
| Wavelength(s) | 0.987 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 60.052, 60.052, 99.257 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 35.904 - 1.650 |
| R-factor | 0.1895 |
| Rwork | 0.188 |
| R-free | 0.21240 |
| Structure solution method | SAD |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.17) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.070 | 1.680 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.057 | 1.675 |
| Rpim | 0.023 | 0.777 |
| Number of reflections | 25589 | 1254 |
| <I/σ(I)> | 24.1 | |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 10.7 | 10.8 |
| CC(1/2) | 1.000 | 0.693 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 298 | 0.2 M Zn Acetate, 0.1 M Na Acetate, 20 % PEG 3350 |
