9Y8O
Crystal structure of the Kelch domain of human KLHL12 with compound 9c
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2021-09-28 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97857 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 79.670, 79.670, 77.260 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 55.525 - 1.286 |
| Rwork | 0.155 |
| R-free | 0.17720 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.871 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 55.530 | 1.310 |
| High resolution limit [Å] | 1.286 | 1.286 |
| Rmerge | 0.090 | 0.471 |
| Number of reflections | 63553 | 6216 |
| <I/σ(I)> | 10.2 | 4.2 |
| Completeness [%] | 91.4 | 100 |
| Redundancy | 12.8 | 12.9 |
| CC(1/2) | 0.999 | 0.980 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.1M Bis-Tris pH 5.5, 0.2M MgCl2 and 25% PEG3350 |
