6EXX

Crystal Structure of Pes4 RRM4

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-04-15
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97921
Spacegroup name	P 21 21 21
Unit cell lengths	27.501, 36.162, 73.583
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	25.790 - 1.100
R-factor	0.1444
Rwork	0.143
R-free	0.16300
RMSD bond length	0.006
RMSD bond angle	1.001
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	Arcimboldo
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.790	1.120
High resolution limit [Å]	1.100	1.100
Rmerge	0.058	0.674
Rmeas	0.061
Number of reflections	30587
<I/σ(I)>	21.51
Completeness [%]	99.8	100
Redundancy	12.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		294	0.2 M Ammonium Nitrate 20% PEG 3350 0.1 M Betaine Monohydrate (as an additive)