3EFK
Structure of c-Met with pyrimidone inhibitor 50
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E SUPERBRIGHT |
Temperature [K] | 130 |
Detector technology | IMAGE PLATE |
Collection date | 2004-07-30 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 76.205, 78.250, 129.684 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.640 - 2.200 |
R-factor | 0.25746 |
Rwork | 0.256 |
R-free | 0.29185 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1r1w |
RMSD bond length | 0.007 |
RMSD bond angle | 1.096 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.640 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.057 | 0.422 |
Number of reflections | 39332 | |
<I/σ(I)> | 20 | 2.5 |
Completeness [%] | 97.8 | 93.9 |
Redundancy | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 5 | 298 | 12% PEG 6000, 1.0M LiCl2, 0.1M Sodium Citrate, pH 5.0, VAPOR DIFFUSION, temperature 298K |