7YRO

Crystal structure of mango fucosyltransferase 13

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	2021-05-15
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	86.700, 163.610, 274.900
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.860 - 2.420
R-factor	0.2109
Rwork	0.210
R-free	0.24760
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	predicted model
RMSD bond length	0.004
RMSD bond angle	0.697
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.19.2_4158: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.560
High resolution limit [Å]	2.420	2.420
Number of reflections	149646	24409
<I/σ(I)>	8.55	1.14
Completeness [%]	100.0
Redundancy	9.78
CC(1/2)	0.995	0.544

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	0.2 M Calcium acetate hydrate and 20% w/v Polyethylene glycol 3,350