6KQ9

A long chain secondary alcohol dehydrogenase of Micrococcus luteus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-09-18
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9796
Spacegroup name	P 31 2 1
Unit cell lengths	64.945, 64.945, 164.045
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	19.814 - 2.251
R-factor	0.2083
Rwork	0.203
R-free	0.25500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4dyd
RMSD bond length	0.007
RMSD bond angle	0.952
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.290
High resolution limit [Å]	2.250	2.250
Rmeas	0.119	0.831
Number of reflections	19681	954
<I/σ(I)>	12.4
Completeness [%]	99.7
Redundancy	4.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		294.15	Sodium citrate tribasic dihydrate