6SDC
Crystal structure of D1228V cMET bound by foretinib
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-02-04 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 42.574, 80.396, 91.306 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 23.450 - 1.670 |
R-factor | 0.203 |
Rwork | 0.201 |
R-free | 0.24200 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 0.970 |
Data reduction software | DIALS |
Data scaling software | DIALS |
Phasing software | PHASER |
Refinement software | BUSTER (2.11.6) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 23.450 | 1.700 |
High resolution limit [Å] | 1.670 | 1.670 |
Number of reflections | 36878 | 1669 |
<I/σ(I)> | 6.3 | |
Completeness [%] | 99.3 | |
Redundancy | 6.1 | |
CC(1/2) | 0.982 | 0.443 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 15 % 2-propanol, 10 % PEG4K, 0.1 M NaHEPES pH 8 |