6RRQ

Crystal structure of tyrosinase PvdP from Pseudomonas aeruginosa bound to copper

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, DESY BEAMLINE P11
Synchrotron site	PETRA III, DESY
Beamline	P11
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-10-22
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	1.0332
Spacegroup name	P 1 21 1
Unit cell lengths	50.722, 114.215, 100.906
Unit cell angles	90.00, 94.82, 90.00

Refinement procedure

Resolution	49.660 - 2.700
R-factor	0.1897
Rwork	0.186
R-free	0.25960
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6rrr
RMSD bond length	0.011
RMSD bond angle	1.467
Data reduction software	XDS
Data scaling software	Aimless (0.7.2)
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0189)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.660	2.830
High resolution limit [Å]	2.700	2.700
Rmerge	0.087	0.552
Rmeas	0.102	0.650
Rpim	0.052	0.339
Number of reflections	31354	4186
<I/σ(I)>	11.1
Completeness [%]	99.3	99.1
Redundancy	3.7	3.6
CC(1/2)	0.996	0.795

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	291	20% PEG 3350, 0.1M Bis-Tris Propane