5EAR
Crystal structure of human WDR5 in complex with compound 9d
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E+ SUPERBRIGHT |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2012-01-13 |
| Detector | RIGAKU RAXIS HTC |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 |
| Unit cell lengths | 46.640, 53.615, 64.707 |
| Unit cell angles | 107.92, 90.95, 109.66 |
Refinement procedure
| Resolution | 50.000 - 1.800 |
| R-factor | 0.1534 |
| Rwork | 0.153 |
| R-free | 0.18500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ur4 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.394 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.830 |
| High resolution limit [Å] | 1.800 | 4.880 | 1.800 |
| Rmerge | 0.042 | 0.030 | 0.207 |
| Total number of observations | 192066 | ||
| Number of reflections | 48569 | ||
| <I/σ(I)> | 17 | ||
| Completeness [%] | 94.1 | 98.8 | 89.8 |
| Redundancy | 4 | 3.9 | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 291 | 22% PEG 3350, 0.1M NH4SO4, 0.1 M BisTris pH5.5 |
