9Y8N
Crystal structure of the Kelch domain of human KLHL12 with compound 8m
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-D |
| Synchrotron site | APS |
| Beamline | 21-ID-D |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2022-03-02 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.99 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 79.633, 79.633, 74.382 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.720 - 1.308 |
| Rwork | 0.159 |
| R-free | 0.20380 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.907 |
| 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] | 33.720 | 1.330 |
| High resolution limit [Å] | 1.308 | 1.308 |
| Rmerge | 0.132 | 0.561 |
| Number of reflections | 45864 | 5505 |
| <I/σ(I)> | 8.4 | 1 |
| Completeness [%] | 99.2 | 78.6 |
| Redundancy | 11.4 | 10.7 |
| CC(1/2) | 0.997 | 0.382 |
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 |
