5F59
The crystal structure of MLL3 SET domain
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-05-31 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.2818 |
| Spacegroup name | P 41 3 2 |
| Unit cell lengths | 129.056, 129.056, 129.056 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.912 - 2.801 |
| R-factor | 0.1843 |
| Rwork | 0.179 |
| R-free | 0.22860 |
| Structure solution method | SAD |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.039 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SHARP |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.900 |
| High resolution limit [Å] | 2.800 | 6.030 | 2.800 |
| Rmerge | 0.135 | 0.068 | 0.530 |
| Rmeas | 0.142 | 0.072 | 0.557 |
| Rpim | 0.044 | 0.024 | 0.169 |
| Total number of observations | 96884 | ||
| Number of reflections | 9555 | ||
| <I/σ(I)> | 9.1 | 7 | |
| Completeness [%] | 99.9 | 99.2 | 100 |
| Redundancy | 10.1 | 9 | 10.6 |
| CC(1/2) | 0.997 | 0.936 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277 | 100 mM Tris-HCl, pH8.5, 3M NaCl |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277 | 100 mM Tris-HCl, pH8.5, 3M NaCl |
