7QDP

Crystal structure of FLT3 T343I in complex with the canonical ligand FL

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, DESY BEAMLINE P11
Synchrotron site	PETRA III, DESY
Beamline	P11
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-09-04
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.98
Spacegroup name	P 1
Unit cell lengths	102.428, 113.377, 123.225
Unit cell angles	105.37, 109.47, 108.22

Refinement procedure

Resolution	48.580 - 3.691
R-factor	0.258
Rwork	0.257
R-free	0.27650
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3qs7
RMSD bond length	0.007
RMSD bond angle	0.990
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.580	3.822
High resolution limit [Å]	3.691	3.691
Number of reflections	45955	7248
<I/σ(I)>	4.71	0.46
Completeness [%]	94.1
Redundancy	1.84
CC(1/2)	0.996	0.170

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.6	287	15 % PEG 3350 25% ethylene glycol