8JMZ

FGFR1 kinase domain with sulfatinib

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	Cu FINE FOCUS
Temperature [K]	80
Detector technology	IMAGE PLATE
Collection date	2021-07-31
Detector	RIGAKU
Wavelength(s)	1.5870
Spacegroup name	C 1 2 1
Unit cell lengths	211.458, 49.873, 66.691
Unit cell angles	90.00, 107.57, 90.00

Refinement procedure

Resolution	40.048 - 1.988
R-factor	0.1656
Rwork	0.163
R-free	0.20480
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7wcl
RMSD bond length	0.013
RMSD bond angle	1.339
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.059
High resolution limit [Å]	1.988	1.988
Rmerge	0.068	0.319
Rmeas	0.073	0.353
Number of reflections	45822	4353
<I/σ(I)>	19.43	4.08
Completeness [%]	100.0	96
Redundancy	6.8	5.2
CC(1/2)	0.999	0.940

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277.15	0.1 M MES pH 6.6,34% PEG 8000,0.2 M ammonium sulfate