5WRI

Crystal structure of human tyrosylprotein sulfotransferase-1 complexed with PAP and C4 peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL38B1
Synchrotron site	SPring-8
Beamline	BL38B1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-10-14
Detector	RAYONIX MX225HE
Wavelength(s)	1.3
Spacegroup name	P 21 21 2
Unit cell lengths	78.576, 155.972, 48.892
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	31.340 - 1.600
R-factor	0.13548
Rwork	0.133
R-free	0.17807
RMSD bond length	0.011
RMSD bond angle	1.516
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0107)

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	1.600
Number of reflections	78540
<I/σ(I)>	20.1
Completeness [%]	98.0
Redundancy	5.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	293	0.2 M trimethylamine N-oxide dihydrate, 0.1 M Tris-HCl, pH 8.5, 20% w/v polyethylene glycol monomethyl ether 2000