3CQE
Wee1 kinase complex with inhibitor PD074291
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 110 |
| Detector technology | IMAGE PLATE |
| Collection date | 2002-10-15 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 69.304, 69.304, 157.601 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.000 - 2.500 |
| R-factor | 0.21242 |
| Rwork | 0.210 |
| R-free | 0.26811 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1x8b |
| RMSD bond length | 0.020 |
| RMSD bond angle | 2.146 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.4.0067) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 63.500 | 2.590 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.074 | 0.460 |
| Number of reflections | 13764 | |
| <I/σ(I)> | 26 | 2 |
| Completeness [%] | 98.2 | 82.2 |
| Redundancy | 8.75 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | HEPES, sodium chloride, pH 7.5, VAPOR DIFFUSION, HANGING DROP |
