1HT0

HUMAN GAMMA-2 ALCOHOL DEHYDROGENSE

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	110
Detector technology	IMAGE PLATE
Collection date	1998-08-31
Detector	RIGAKU RAXIS IIC
Wavelength(s)	1.5418
Spacegroup name	P 1 21 1
Unit cell lengths	56.400, 71.500, 92.100
Unit cell angles	90.00, 102.90, 90.00

Refinement procedure

Resolution	44.000 - 2.000
R-factor	0.196
Rwork	0.193
R-free	0.23100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1deh
RMSD bond length	0.009
RMSD bond angle	1.400 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	X-PLOR (3.851)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.000	2.070
High resolution limit [Å]	2.000	2.000
Rmerge	0.082	0.216
Total number of observations	188548 *
Number of reflections	47641
<I/σ(I)>	21.3	6.7
Completeness [%]	97.9	86.8
Redundancy	4	3.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	unknown *	9	4 *	100 mM Tris, 4 mM NAD+, 18% PEG 6000, 10 mg/ml protein, pH 9.0, VAPOR DIFFUSION, SITTING DROP at 277K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	PEG6000	18 (%)
2	1	1	Tris-HCl	50 (mM)
3	1	1	NAD+	4 (mM)
4	1	1	protein	10 (mg/ml)