4HW7

Crystal structure of FMS kinase domain with a small molecular inhibitor, PLX647-OME

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.3.1
Synchrotron site	ALS
Beamline	8.3.1
Temperature [K]	100
Detector technology	CCD
Collection date	2012-08-11
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.1159
Spacegroup name	P 43 21 2
Unit cell lengths	62.964, 62.964, 182.780
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	51.900 - 2.900
R-factor	0.222
Rwork	0.220
R-free	0.26700
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.891
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	PHENIX ((phenix.refine: 1.7.3_928))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	59.500	3.060
High resolution limit [Å]	2.900	2.900
Number of reflections	8735
Completeness [%]	99.6	99.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	277	20% PEG8K, 0.2M MgCl and 0.1M Tris, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K