5NQ8

Crystal structure of laccases from Pycnoporus sanguineus, izoform II

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-06-06
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.918
Spacegroup name	P 43 3 2
Unit cell lengths	184.410, 184.410, 184.410
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.100 - 2.000
R-factor	0.15107
Rwork	0.150
R-free	0.17295
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2xyb
RMSD bond length	0.014
RMSD bond angle	1.622
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.100
High resolution limit [Å]	2.000	2.000
Rmerge	0.088	0.700
Number of reflections	72366	9696
<I/σ(I)>	0.091	3.17
Completeness [%]	99.0	100
Redundancy	16.5	8.3
CC(1/2)	1.000	0.870

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	293	1.1 M sodium malonate pH 7.0, 0.1M HEPES 7.0 0.5% Jeffamine pH 7.0.