6WTW

Structure of LaINDY crystallized in the presence of alpha-ketoglutarate and malate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-02-13
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	91.328, 76.609, 96.946
Unit cell angles	90.00, 90.48, 90.00

Refinement procedure

Resolution	50.090 - 2.860
R-factor	0.2239
Rwork	0.220
R-free	0.27480
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6wu1
RMSD bond length	0.006
RMSD bond angle	0.940
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (dev_3707)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.090	2.900
High resolution limit [Å]	2.860	2.860
Number of reflections	30640	1410
<I/σ(I)>	16
Completeness [%]	99.4
Redundancy	6.3
CC(1/2)	0.966	0.800

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.8	291	30% Jeffamine ED-2001, 100 mM HEPES pH 6.8