22TG
Crystal Structure of MYST histone acetyltransferase KAT6A in complex with Compound 20
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 298 |
| Detector technology | CCD |
| Collection date | 2022-08-17 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 58.685, 46.405, 120.922 |
| Unit cell angles | 90.00, 90.02, 90.00 |
Refinement procedure
| Resolution | 43.324 - 2.400 |
| Rwork | 0.293 |
| R-free | 0.37250 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6ct2 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.814 |
| Data reduction software | CrystFEL |
| Data scaling software | CrystalClear |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0405) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.400 | 2.450 |
| High resolution limit [Å] | 2.360 | 2.360 |
| Rmerge | 0.082 | 1.200 |
| Number of reflections | 26843 | 2587 |
| <I/σ(I)> | 6 | |
| Completeness [%] | 98.2 | |
| Redundancy | 5.8 | |
| CC(1/2) | 0.999 | 0.696 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 298.15 | 0.2 M Sod. Malonate, pH 6.0, 20% PEG3350 |
