1D7O

CRYSTAL STRUCTURE OF BRASSICA NAPUS ENOYL ACYL CARRIER PROTEIN REDUCTASE COMPLEXED WITH NAD AND TRICLOSAN

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	298
Detector technology	IMAGE PLATE
Detector	MARRESEARCH
Spacegroup name	P 42 21 2
Unit cell lengths	70.500, 70.500, 118.000
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	10.000 - 1.900
Rwork	0.162
R-free	0.22500
RMSD bond length	0.010
RMSD bond angle	1.700
Data scaling software	SCALEPACK
Refinement software	TNT

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	1.940
High resolution limit [Å]	1.900	1.900
Rmerge	0.055	0.300
Number of reflections		1547 *
Completeness [%]	96.0	98

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	6.2 *	17 *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	enzyme	10 (mg/ml)
2	1	drop		10 (mM)
3	1	drop	dithiothreitol	1 (mM)
4	1	reservoir	nucleotide	0.15 (M)
5	1	reservoir	ammonium sulfate	2.0 (M)
6	1	reservoir	HEPES/NaOH	0.1 (M)
7	1	reservoir	NAD+