7DO6

Crystal structure of Azotobacter vinelandii L-rhamnose 1-dehydrogenase(NADP bound-form)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL45XU
Synchrotron site	SPring-8
Beamline	BL45XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-04-05
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.0000
Spacegroup name	P 1
Unit cell lengths	78.633, 81.571, 86.389
Unit cell angles	87.68, 75.53, 89.35

Refinement procedure

Resolution	50.030 - 2.370
R-factor	0.2076
Rwork	0.205
R-free	0.25730
Structure solution method	MOLECULAR REPLACEMENT
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.030	50.030	2.510
High resolution limit [Å]	2.370	7.050	2.370
Rmerge	0.205	0.071	1.003
Rmeas	0.268	0.092	1.311
Total number of observations	354663
Number of reflections	82779	6116	25333
<I/σ(I)>	3.68	11.5	0.92
Completeness [%]	96.1	94.9	93
Redundancy	2.185	2.283	2.149
CC(1/2)	0.965	0.982	0.433

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293	0.1 M Tris-HCl (pH 8.0), 0.2 M NaCl, 24.5% (w/v) PEG 3350