6J76

Structure of 3,6-anhydro-L-galactose Dehydrogenase in Complex with NAP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-07-17
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9791
Spacegroup name	P 2 21 21
Unit cell lengths	76.378, 90.737, 149.052
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.984 - 2.368
R-factor	0.1626
Rwork	0.160
R-free	0.20440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6j75
RMSD bond length	0.007
RMSD bond angle	1.053
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.453
High resolution limit [Å]	2.368	2.368
Rmerge	0.165	0.340
Number of reflections	42618	3935
<I/σ(I)>	44.27
Completeness [%]	99.0
Redundancy	13.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	NaAC, sodium cacodylate trihydrate, PEG 8,000