9IJ6
Crystal structure of the complex of erythrose-4-phosphate dehydrogenase from Acinetobacter baumannii with Adenosine phosphate at 2.40 A resolution.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 298 |
| Detector technology | PIXEL |
| Collection date | 2023-07-28 |
| Detector | DECTRIS EIGER2 X 9M |
| Wavelength(s) | 0.87313 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 147.578, 167.012, 155.058 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 83.646 - 2.400 |
| Rwork | 0.170 |
| R-free | 0.21960 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.527 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 83.646 | 2.450 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.214 | 2.050 |
| Rmeas | 0.227 | 2.170 |
| Rpim | 0.071 | 0.700 |
| Number of reflections | 74905 | 4617 |
| <I/σ(I)> | 7.6 | 1 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 9.1 | 9.2 |
| CC(1/2) | 0.996 | 0.600 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | EVAPORATION | 7.5 | 298 | 0.2M MgSO4.6H2O, 0.1M HEPES sodium (pH 7.5) |
