3HDH

PIG HEART SHORT CHAIN L-3-HYDROXYACYL COA DEHYDROGENASE REVISITED: SEQUENCE ANALYSIS AND CRYSTAL STRUCTURE DETERMINATION

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Temperature [K]	295
Collection date	1985-01
Spacegroup name	C 2 2 21
Unit cell lengths	227.200, 82.100, 124.700
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 2.800
R-factor	0.223 *
Rwork	0.223
R-free	0.28700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3had
RMSD bond length	0.009
RMSD bond angle	1.500
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.970
High resolution limit [Å]	2.800	2.800
Rmerge	0.046 *
Number of reflections	28840
<I/σ(I)>	4.9
Completeness [%]	98.0	85
Redundancy	4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	gel filtration *	8		10 MM TRIS, PH 8.0, + 1MM DTT + 11-14% PEG 6K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	Tris	10 (mM)
2	1	drop	dithiothreitol	1 (mM)
3	1	drop		0.05 (%)
4	1	drop	protein	5 (mg/ml)
5	1	reservoir	PEG6000	11-14 (%(w/v))