3A4P
human c-MET kinase domain complexed with 6-benzyloxyquinoline inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-5A |
| Synchrotron site | Photon Factory |
| Beamline | BL-5A |
| Temperature [K] | 95 |
| Detector technology | CCD |
| Collection date | 2007-03-10 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 157.227, 42.733, 46.039 |
| Unit cell angles | 90.00, 102.91, 90.00 |
Refinement procedure
| Resolution | 44.860 - 2.540 |
| Rwork | 0.183 |
| R-free | 0.24000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDB ID 1R1W |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.813 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 76.696 | 76.700 | 2.610 |
| High resolution limit [Å] | 2.480 | 11.360 | 2.540 |
| Rmerge | 0.146 | 0.062 | 0.650 |
| Total number of observations | 401 | 2597 | |
| Number of reflections | 10051 | ||
| <I/σ(I)> | 9.4 | 1.2 | |
| Completeness [%] | 99.9 | 99.8 | 100 |
| Redundancy | 3.5 | 3.1 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 285 | 14%(w/v) PEG MME 5000, 5%(v/v) isopropanol, 12%(v/v) MPD, 0.1M Tris-Cl, 15%(v/v) Glycerol, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 285K |
