6HT9

Mouse fetuin-B in complex with crayfish astacin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-18
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.979182
Spacegroup name	P 21 21 21
Unit cell lengths	83.400, 85.800, 168.700
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.120 - 3.100
R-factor	0.217
Rwork	0.216
R-free	0.27000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ast
RMSD bond length	0.010
RMSD bond angle	1.140
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	84.400	3.280
High resolution limit [Å]	3.100	3.100
Rmerge	0.153	1.499
Rmeas	0.160	1.567
Number of reflections	22647
<I/σ(I)>	14.1	2
Completeness [%]	100.0	100
Redundancy	11.7	11.6
CC(1/2)	0.998	0.771

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	ammonium sulfate, polyethylene glycol 2000, sodium acetate, pH 4.6.