2OXI

REFINED CRYSTAL STRUCTURE OF CU-SUBSTITUTED ALCOHOL DEHYDROGENASE AT 2.1 ANGSTROMS RESOLUTION

Experimental procedure

Spacegroup name	P 1 21 1
Unit cell lengths	44.400, 180.600, 50.800
Unit cell angles	90.00, 108.00, 90.00

Refinement procedure

Resolution	12.000 * - 2.100
R-factor	0.161 *
Rwork	0.160
RMSD bond length	0.019
RMSD bond angle	26.200 *
Phasing software	X-PLOR
Refinement software	X-PLOR

Data quality characteristics

	Overall
Low resolution limit [Å]	12.000 *
High resolution limit [Å]	2.100 *
Rmerge	0.044 *
Total number of observations	81533 *
Number of reflections	41119 *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	NADH	0.75 (mM)
2	1	1	DMSO	1.5 (%(v/v))
3	1	1	Tris-HCl	0.05 (M)	pH8.2
4	1	1	MPD	10 (%)