3TN8
CDK9/cyclin T in complex with CAN508
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-03-14 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9762 |
| Spacegroup name | H 3 |
| Unit cell lengths | 173.420, 173.420, 97.891 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 37.068 - 2.950 |
| R-factor | 0.1786 |
| Rwork | 0.176 |
| R-free | 0.22060 |
| Structure solution method | rigid body refinement |
| Starting model (for MR) | 3blh |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.842 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.2.25) |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.7.1_743) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 43.355 | 81.923 | 3.110 |
| High resolution limit [Å] | 2.950 | 9.330 | 2.950 |
| Rmerge | 0.072 | 0.030 | 0.589 |
| Total number of observations | 2653 | 12557 | |
| Number of reflections | 23081 | ||
| <I/σ(I)> | 13.3 | 21.1 | 1.2 |
| Completeness [%] | 99.8 | 96.4 | 100 |
| Redundancy | 3.7 | 3.7 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.2 | 278 | 12% PEG 1K, 50 mM sodium/potassium phosphate, 4 mM TCEP, pH 6.2, VAPOR DIFFUSION, HANGING DROP, temperature 278K |
