5SVO

Structure of IDH2 mutant R140Q

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 17-ID
Synchrotron site	APS
Beamline	17-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-10-13
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	58.661, 119.207, 127.496
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	87.080 - 1.870
R-factor	0.1913
Rwork	0.190
R-free	0.21810
RMSD bond length	0.008
RMSD bond angle	1.020
Data reduction software	XDS
Data scaling software	autoPROC
Phasing software	PHASER
Refinement software	BUSTER (2.11.6)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	127.500
High resolution limit [Å]	1.870	1.870
Number of reflections	75021
<I/σ(I)>	25.6
Completeness [%]	99.9
Redundancy	6.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		277	0.1M Hepes pH7.5, 0.2M NaCl, 25% (w/v) PEG3350