8H2B

Crystal structure of alcohol dehydrogenase from Zobellia galactanivorans

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 11C
Synchrotron site	PAL/PLS
Beamline	11C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-12-18
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9794
Spacegroup name	P 21 21 21
Unit cell lengths	90.569, 92.670, 154.118
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.580 - 2.100
R-factor	0.1623
Rwork	0.161
R-free	0.20470
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6ljh
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.140
High resolution limit [Å]	2.100	2.100
Number of reflections	76289	3735
<I/σ(I)>	15
Completeness [%]	99.9
Redundancy	12.6
CC(1/2)	0.989	0.734

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	Tris-HCl, pH 7.5, KCl and PEG 3350