6FSL

F194W mutant of the dye-decolorizing peroxidase (DYP) from Pleurotus ostreatus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	110
Detector technology	PIXEL
Collection date	2015-12-12
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.976252
Spacegroup name	P 21 21 21
Unit cell lengths	61.869, 118.140, 133.078
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	88.350 - 2.500
R-factor	0.1836
Rwork	0.181
R-free	0.24317
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3afv
RMSD bond length	0.012
RMSD bond angle	1.597
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	88.350	2.630
High resolution limit [Å]	2.500	2.500
Rmerge	0.268	0.923
Rpim	0.167	0.570
Number of reflections	34465	4873
<I/σ(I)>	7.7	2.7
Completeness [%]	99.6	98
Redundancy	6.5	6.4
CC(1/2)	0.982	0.757

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.75	295	0.2M MES pH=5.75 25% PEG2000 MME