5TES

TEV Cleaved Human ATP Citrate Lyase Bound to Citrate and ADP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-07-17
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.97948
Spacegroup name	P 21 21 21
Unit cell lengths	56.170, 85.140, 199.010
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.890 - 2.400
R-factor	0.197
Rwork	0.194
R-free	0.25200
RMSD bond length	0.003
RMSD bond angle	0.530
Refinement software	PHENIX ((1.10_2152: ???))

Data quality characteristics

	Overall
Low resolution limit [Å]	49.750
High resolution limit [Å]	2.400
Number of reflections	37140
<I/σ(I)>	7.1
Completeness [%]	97.4
Redundancy	3.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.8	294	12.5% P3350, 100 mM TrisHCl pH 8.8, 125 mM ammonium chloride