9INX
Crystal structure of DAPK1 in complex with compound 10
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-17A |
| Synchrotron site | Photon Factory |
| Beamline | BL-17A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-02-24 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.915 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 46.603, 62.266, 88.397 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.200 - 1.720 |
| R-factor | 0.1826 |
| Rwork | 0.181 |
| R-free | 0.21120 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.060 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.21_5207: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.600 | 1.750 |
| High resolution limit [Å] | 1.720 | 1.720 |
| Rmeas | 0.058 | 0.982 |
| Rpim | 0.021 | 0.346 |
| Number of reflections | 27900 | 1426 |
| <I/σ(I)> | 21.6 | 2.2 |
| Completeness [%] | 99.6 | 99.2 |
| Redundancy | 7.4 | 7.8 |
| CC(1/2) | 1.000 | 0.744 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | PEG 400, ammonium sulfate, MES pH 6.5 |
