1UNH
Structural mechanism for the inhibition of CDK5-p25 by roscovitine, aloisine and indirubin.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 287 |
| Detector technology | CCD |
| Collection date | 2001-04-15 |
| Detector | ADSC CCD |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 149.541, 90.124, 83.158 |
| Unit cell angles | 90.00, 93.29, 90.00 |
Refinement procedure
| Resolution | 19.880 - 2.350 |
| R-factor | 0.229 |
| Rwork | 0.229 |
| R-free | 0.23000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1h4l |
| RMSD bond length | 0.016 |
| RMSD bond angle | 2.046 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.300 |
| High resolution limit [Å] | 2.250 | 2.250 |
| Rmerge | 0.075 | 0.390 |
| Number of reflections | 50596 | |
| <I/σ(I)> | 20.4 | 4.5 |
| Completeness [%] | 98.8 | 99.9 |
| Redundancy | 17.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 13% PEG 3350, 0.1 M KI 0.1 M BISTRISPROPANE PH 7.0, 10 MM DTT |
