2OP1

Crystal structure of plasmodium falciparum enoyl ACP reductase with triclosan reductase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	120
Detector technology	IMAGE PLATE
Detector	RIGAKU
Wavelength(s)	1.54178
Spacegroup name	P 43 21 2
Unit cell lengths	131.498, 131.498, 82.334
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 2.600
R-factor	0.2071
Rwork	0.207
R-free	0.27010
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1NHD
Data reduction software	XFIT
Data scaling software	HKL-2000
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.690
High resolution limit [Å]	2.600	2.600
Number of reflections	22516
Completeness [%]	99.4	99.7
Redundancy		6.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289	2.35M (NH4)2SO4, 0.1M AcONa, VAPOR DIFFUSION, HANGING DROP, temperature 289K