6JQR

Crystal structure of FLT3 in complex with gilteritinib

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-05-17
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9999
Spacegroup name	P 43 21 2
Unit cell lengths	82.367, 82.367, 146.469
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	71.790 - 2.200
R-factor	0.181
Rwork	0.179
R-free	0.21300
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.012
RMSD bond angle	1.587
Data reduction software	XDS
Data scaling software	XSCALE
Refinement software	REFMAC (5.8.0155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	71.790	2.450
High resolution limit [Å]	2.200	2.200
Rmerge	0.040	0.441
Number of reflections	24524
<I/σ(I)>	49.61
Completeness [%]	93.1	81.8
Redundancy	15.7	16.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	buffer, salt, precipitant