5GRH

Crystal structure of the alpha gamma heterodimer of human IDH3 in complex with Mg(2+)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-06-02
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0000
Spacegroup name	P 31 2 1
Unit cell lengths	118.397, 118.397, 143.163
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	19.710 - 2.800
R-factor	0.2257
Rwork	0.224
R-free	0.25920
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1t09
RMSD bond length	0.006
RMSD bond angle	1.088
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.710	2.900
High resolution limit [Å]	2.800	2.800
Number of reflections	28718
<I/σ(I)>	9.6
Completeness [%]	98.9
Redundancy	10.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M HEPES-Na, pH7.5, 50 mM MgCl2, 30%(v/v) PEGMME 550