5M6B

structure of recombinant mushroom tyrosinase (abPPO4)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-07-03
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.873
Spacegroup name	C 1 2 1
Unit cell lengths	287.300, 52.090, 152.660
Unit cell angles	90.00, 98.03, 90.00

Refinement procedure

Resolution	48.900 - 3.250
R-factor	0.2522
Rwork	0.251
R-free	0.27540
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4oua
RMSD bond length	0.009
RMSD bond angle	0.695
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER ((1.10.1-2155))
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.900	3.370
High resolution limit [Å]	3.250	3.250
Rmerge	0.251	1.108
Number of reflections	35520
<I/σ(I)>	5.68	1.91
Completeness [%]	98.4
Redundancy	4.2	4.4
CC(1/2)	0.994	0.826

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.8	293	50 mM sodium cacodylate pH 5.8 and 13 % (w/w) PEG 4000