6HQI

holo-form of polyphenol oxidase from Solanum lycopersicum

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE MASSIF-1
Synchrotron site	ESRF
Beamline	MASSIF-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-12-01
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.9677
Spacegroup name	P 1 21 1
Unit cell lengths	60.620, 54.100, 69.820
Unit cell angles	90.00, 104.60, 90.00

Refinement procedure

Resolution	42.231 - 1.850
R-factor	0.1928
Rwork	0.191
R-free	0.22890
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5ce9
RMSD bond length	0.017
RMSD bond angle	0.876
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.10_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.231	1.920
High resolution limit [Å]	1.850	1.850
Number of reflections	37575
<I/σ(I)>	6.81
Completeness [%]	100.0
Redundancy	6.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	50 mM sodium citrate pH 6.6, 13% PEG 8000