4FJY

Crystal structure of PI3K-gamma in complex with quinoline-indoline inhibitor 24f

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E SUPERBRIGHT
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2008-06-11
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	C 1 2 1
Unit cell lengths	144.223, 67.711, 106.772
Unit cell angles	90.00, 95.08, 90.00

Refinement procedure

Resolution	30.000 - 2.900
R-factor	0.2026
Rwork	0.197
R-free	0.27450
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.007
RMSD bond angle	1.145
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	REFMAC
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	30.000	30.000	3.000
High resolution limit [Å]	2.900	6.230	2.900
Rmerge	0.071	0.041	0.563
Number of reflections	22917
<I/σ(I)>	16.1
Completeness [%]	99.6	99.2	98.2
Redundancy	3.3	3.3	2.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.3	293	22% PEG 3350, 250 mM ammonium sulfate, 10 mM EDTA, 100 mM Tris, pH 7.3, VAPOR DIFFUSION, HANGING DROP, temperature 293K