7JWF

Crystal structure of PdGH110B D344N in complex with alpha-(1,3)-galactobiose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-002
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-12-02
Detector	DECTRIS PILATUS 200K
Wavelength(s)	1.514
Spacegroup name	P 1 21 1
Unit cell lengths	98.517, 124.763, 142.423
Unit cell angles	90.00, 93.86, 90.00

Refinement procedure

Resolution	29.759 - 2.187
R-factor	0.2065
Rwork	0.205
R-free	0.23710
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7jw4
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	REFMAC
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.240
High resolution limit [Å]	2.187	2.200
Number of reflections	174470	7427
<I/σ(I)>	7.1
Completeness [%]	98.6
Redundancy	3.6
CC(1/2)	0.991	0.833

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	291	PEG 3350, HEPES, NaI, Tacsimate