9PDH
X-ray structure of WT Drosophila Ahcy bound to NAD and adenosine at 2.50 A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-04-04 |
| Detector | DECTRIS EIGER2 S 4M |
| Wavelength(s) | 1.5406 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 89.315, 169.411, 127.368 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.450 - 2.500 |
| R-factor | 0.2311 |
| Rwork | 0.230 |
| R-free | 0.27020 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.728 |
| Data reduction software | CrysalisPro |
| Data scaling software | CrysalisPro |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.21.2_5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.450 | 2.560 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.260 | 0.851 |
| Rmeas | 0.289 | 0.950 |
| Rpim | 0.125 | 0.413 |
| Number of reflections | 66928 | 4718 |
| <I/σ(I)> | 6.51 | 1.93 |
| Completeness [%] | 99.3 | 99.94 |
| Redundancy | 5.3 | 5.3 |
| CC(1/2) | 0.925 | 0.459 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1 M Bis-Tris pH 6.5, 16% PEG MME 5000 |
