5IHC
MELK in complex with NVS-MELK12B
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-08-07 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.00000 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 57.370, 67.810, 103.860 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.360 - 2.140 |
| R-factor | 0.1794 |
| Rwork | 0.178 |
| R-free | 0.20840 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.020 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.1.27) |
| Refinement software | BUSTER-TNT |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 67.820 | 67.820 | 2.390 |
| High resolution limit [Å] | 2.140 | 4.780 | 2.140 |
| Rmerge | 0.045 | 0.026 | 0.376 |
| Rmeas | 0.050 | ||
| Rpim | 0.021 | ||
| Total number of observations | 123757 | ||
| Number of reflections | 22899 | ||
| <I/σ(I)> | 19.6 | ||
| Completeness [%] | 99.4 | 97.3 | 99.8 |
| Redundancy | 5.4 | 5.1 | 5.6 |
| CC(1/2) | 0.999 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277 | 100mM Hepes, pH 7.6, 0.2M NaCl, 4.5-16.5% PEG3350 |
