4EEV
Crystal structure of c-Met in complex with LY2801653
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 31-ID |
| Synchrotron site | APS |
| Beamline | 31-ID |
| Detector technology | CCD |
| Detector | RAYONIX MX225HE |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 40.508, 63.886, 111.631 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.940 - 1.800 |
| R-factor | 0.1903 |
| Rwork | 0.189 |
| R-free | 0.21530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.588 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (2.7.2) |
| Phasing software | AMoRE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 19.940 | 19.929 | 1.590 |
| High resolution limit [Å] | 1.511 | 4.770 | 1.510 |
| Rmerge | 0.086 | 0.060 | 0.060 |
| Total number of observations | 13348 | 53212 | |
| Number of reflections | 45914 | ||
| <I/σ(I)> | 10.1 | 12.8 | 0.1 |
| Completeness [%] | 99.0 | 97 | 94.2 |
| Redundancy | 9.4 | 8.4 | 8.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 16% PEG 10.000, 0.1 M HEPES, and 5% ethylene glycol, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K |
