1BS0

PLP-DEPENDENT ACYL-COA SYNTHASE

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	EMBL/DESY, HAMBURG BEAMLINE BW7B
Synchrotron site	EMBL/DESY, HAMBURG
Beamline	BW7B
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	1996-06-15
Detector	MARRESEARCH
Spacegroup name	P 31 1 2
Unit cell lengths	58.520, 58.520, 194.640
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	10.000 - 1.650
R-factor	0.1779
R-free	0.21240
Structure solution method	MIR
RMSD bond length	0.022
RMSD bond angle	0.026
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	MLPHARE
Refinement software	SHELXL-97

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	15.000	1.680
High resolution limit [Å]	1.640	1.650
Rmerge	0.084	0.369
Number of reflections	46252
<I/σ(I)>	31.3	3.3
Completeness [%]	100.0	99.6 *
Redundancy	14.3	8.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	7.9		PROTEIN WAS CRYSTALLIZED FROM 0.2M AMMONIUM SULPHATE, 200MM BIS-TRIS,, pH 7.9

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	10 (mg/ml)
2	1	reservoir	ammonium sulfate	1.6 (M)
3	1	reservoir	Bis-Tris-propane	200 (mM)