8S19

c-KIT kinase domain in complex with staurosporine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE MASSIF-3
Synchrotron site	ESRF
Beamline	MASSIF-3
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-11-18
Detector	DECTRIS EIGER X 4M
Wavelength(s)	0.9677
Spacegroup name	P 21 21 21
Unit cell lengths	59.040, 59.340, 192.920
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.610 - 2.300
R-factor	0.1857
Rwork	0.184
R-free	0.20810
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.470
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.610	2.400
High resolution limit [Å]	2.300	2.300
Number of reflections	30570	3617
<I/σ(I)>	10.76	2.39
Completeness [%]	98.6
Redundancy	5.72
CC(1/2)	0.996	0.739

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		285.15	protein concentration: 5 mg/mL, 25% PEG3350, 100 mM Na2-tartrate, cryo protected with 2.5 M NaCl (5M NaCl 1:1 diluted in reservoir)