4YHT
bRaf complexed with an inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 93 |
Detector technology | CCD |
Collection date | 2009-12-09 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 99.783, 99.783, 161.504 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 3.050 |
R-factor | 0.2003 |
Rwork | 0.199 |
R-free | 0.23290 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.173 |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 3.100 |
High resolution limit [Å] | 3.050 | 8.270 | 3.050 |
Rmerge | 0.153 | 0.038 | 0.692 |
Total number of observations | 139786 | ||
Number of reflections | 16082 | ||
<I/σ(I)> | 6.1 | ||
Completeness [%] | 99.3 | 96.3 | 99.9 |
Redundancy | 8.7 | 8 | 8.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | 100 mM Tris pH 8.0, 650 mM NaCl, 3-6 % PEG 8000 |