3WPN
Kinesin spindle protein Eg5 in complex with ATP-competitive inhibitor PVZB1194
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-17A |
| Synchrotron site | Photon Factory |
| Beamline | BL-17A |
| Temperature [K] | 95 |
| Detector technology | CCD |
| Collection date | 2012-11-04 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9800 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 71.912, 95.425, 59.015 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.880 - 2.800 |
| R-factor | 0.23121 |
| Rwork | 0.225 |
| R-free | 0.29008 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1q0b |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.330 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0044) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.850 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.084 | 0.454 |
| Number of reflections | 10303 | |
| <I/σ(I)> | 38.7 | 6.8 |
| Completeness [%] | 98.2 | 98.8 |
| Redundancy | 6.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 277 | 19% PEG3350, 0.1M MES, 0.2M NaNO3, pH 6.0, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
