3F3W
Drug resistant cSrc kinase domain in complex with inhibitor RL45 (Type II)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 90 |
| Detector technology | CCD |
| Collection date | 2008-09-02 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.004730 |
| Spacegroup name | P 1 |
| Unit cell lengths | 42.060, 63.690, 75.120 |
| Unit cell angles | 78.70, 87.02, 89.96 |
Refinement procedure
| Resolution | 40.000 - 2.600 |
| R-factor | 0.223 |
| Rwork | 0.221 |
| R-free | 0.27700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2oiq |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.865 |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 2.700 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.066 | 0.270 |
| Number of reflections | 23074 | 2442 |
| <I/σ(I)> | 16.1 | 5.7 |
| Completeness [%] | 98.2 | 97.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 10% PEG 20000, 15% glycerol, 85mM MES, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
