4TQ2

Structure of S-type Phycobiliprotein Lyase CPES from Guillardia theta

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-10-18
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97794, 0.97856
Spacegroup name	C 2 2 21
Unit cell lengths	80.830, 116.580, 58.750
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.574 - 1.950
R-factor	0.2111
Rwork	0.209
R-free	0.24520
Structure solution method	SAD
RMSD bond length	0.016
RMSD bond angle	1.544
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.9_1692))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	19.574	19.574	2.000
High resolution limit [Å]	1.950	8.720	1.950
Rmerge	0.050	0.026	2.094
Rmeas	0.052	0.027	2.176
Total number of observations	266849
Number of reflections	20588	248	1496
<I/σ(I)>	24.26	77.82	1.42
Completeness [%]	99.7	89.9	99.6
Redundancy	13

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	4.6	291	0.015M CoCl2, 0.085M sodium acetate pH 4.6, 0.85M 1,6-hexanediol, 7% glycerol