8GVJ

Crystal structure of cMET kinase domain bound by D6808

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL02U1
Synchrotron site	SSRF
Beamline	BL02U1
Temperature [K]	100
Detector technology	CCD
Collection date	2022-09-08
Detector	ADSC QUANTUM 1
Wavelength(s)	0.979183
Spacegroup name	P 41 21 2
Unit cell lengths	66.078, 66.078, 187.302
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.380 - 2.710
R-factor	0.2206
Rwork	0.218
R-free	0.26170
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6sde
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.380	2.807
High resolution limit [Å]	2.710	2.710
Rmerge	0.032
Number of reflections	23949	2336
<I/σ(I)>	13.31
Completeness [%]	99.9
Redundancy	11.4
CC(1/2)	0.997	0.896

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	25% PEG 8K