8ANS

Crystal structure of D1228V c-MET bound by compound 1.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-11-24
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97625
Spacegroup name	P 21 21 21
Unit cell lengths	50.890, 52.830, 96.180
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.560 - 2.010
R-factor	0.2318
Rwork	0.229
R-free	0.27700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6sdc
RMSD bond length	0.008
RMSD bond angle	1.060
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	BUSTER (2.11.8 (24-FEB-2021))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	35.560	35.570	2.040
High resolution limit [Å]	2.010	5.450	2.010
Rmeas	0.169	0.076	1.456
Rpim	0.067	0.032	0.567
Total number of observations	113620	5669	5830
Number of reflections	17868	1006	891
<I/σ(I)>	6.9	18.1	1.4
Completeness [%]	99.9	100	99.9
Redundancy	6.4	5.6	6.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	15 % PEG10K, 100 mM PCPT pH 7.5