2C6E
Aurora A kinase activated mutant (T287D) in complex with a 5- aminopyrimidinyl quinazoline inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX9.6 |
Synchrotron site | SRS |
Beamline | PX9.6 |
Temperature [K] | 291 |
Detector technology | CCD |
Collection date | 2000-11-07 |
Detector | ADSC CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 52.603, 88.421, 67.832 |
Unit cell angles | 90.00, 90.01, 90.00 |
Refinement procedure
Resolution | 53.000 - 2.100 |
Rwork | 0.200 |
R-free | 0.27000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB ENTRIES 1ATP AND 2C6D |
RMSD bond length | 0.019 |
RMSD bond angle | 1.800 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 |
Phasing software | EPMR |
Refinement software | CNX (2000) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 53.000 | 2.250 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.070 | 0.300 |
Number of reflections | 26294 | |
<I/σ(I)> | 7 | 2.1 |
Completeness [%] | 72.5 | 25.5 |
Redundancy | 1.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | pH 7.50 |