4UYU

STRUCTURE OF THE WNT DEACYLASE NOTUM - CRYSTAL FORM I IODIDE COMPLEX - 2.3A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-12-15
Detector	DECTRIS PILATUS
Spacegroup name	P 21 21 2
Unit cell lengths	74.220, 177.564, 60.991
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	88.780 - 2.300
R-factor	0.20945
Rwork	0.208
R-free	0.24346
Structure solution method	OTHER
Starting model (for MR)	NONE
RMSD bond length	0.010
RMSD bond angle	1.329
Data reduction software	XDS
Data scaling software	Aimless
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall
Low resolution limit [Å]	47.000
High resolution limit [Å]	2.300
Rmerge	0.140
Number of reflections	36714
<I/σ(I)>	10.2
Completeness [%]	100.0
Redundancy	7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7.5		20 %W/V PEG 3350 0.1 M BT PROPANE PH 6.5 0.2 M NAI