4BM0

CRYSTAL STRUCTURE OF FUNGAL VERSATILE PEROXIDASE I FROM PLEUROTUS OSTREATUS - CRYSTAL FORM VII

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-11-06
Detector	DECTRIS PILATUS
Spacegroup name	P 43
Unit cell lengths	96.700, 96.700, 38.400
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.350 - 2.199
R-factor	0.2301
Rwork	0.228
R-free	0.27120
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3fmu
RMSD bond length	0.005
RMSD bond angle	0.923
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((PHENIX.REFINE))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.330
High resolution limit [Å]	2.200	2.200
Rmerge	0.210	1.130
Number of reflections	18474
<I/σ(I)>	11.1	2.1
Completeness [%]	99.3	96.2
Redundancy	11.3	10.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1				0.1 M NA-HEPES AT PH 7.5, 0.2 M NA-ACETATE & 20 % PEG 3000.