1HW1

THE FADR-DNA COMPLEX: TRANSCRIPTIONAL CONTROL OF FATTY ACID METABOLISM IN ESCHERICHIA COLI

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2000-09-02
Spacegroup name	P 1 21 1
Unit cell lengths	59.346, 86.996, 59.128
Unit cell angles	90.00, 120.18, 90.00

Refinement procedure

Resolution	40.000 - 1.500
R-factor	0.198 *
Rwork	0.198
R-free	0.21600
Structure solution method	MAD
RMSD bond length	0.004 *
RMSD bond angle	1.109 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000
High resolution limit [Å]	1.500
Rmerge	0.067	0.180 *
Total number of observations	1306223 *
Number of reflections	80658
<I/σ(I)>	7.8
Completeness [%]	97.2	78.9 *
Redundancy	16.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	5.6	18 *	ammonium sulfate, lithium sulfate, sodium citrate, zinc chloride, pH 5.6, EVAPORATION, temperature 290.0K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	10 (mg/ml)
2	1	reservoir	sodium citrate	0.1 (M)	pH5.6
3	1	reservoir	ammonium sulfate	0.7 (M)
4	1	reservoir	lithium sulfate	0.2 (M)
5	1	reservoir	zinc chloride	5 (mM)