7WXJ

Crystal Structure of PL-5 family polysaccharide lyase PanPL from Pandoraea apista at pH3.5 in apo form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-03-12
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	1.07234
Spacegroup name	C 1 2 1
Unit cell lengths	99.006, 46.096, 64.586
Unit cell angles	90.00, 91.08, 90.00

Refinement procedure

Resolution	64.570 - 2.100
R-factor	0.1915
Rwork	0.189
R-free	0.22970
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7fhx
RMSD bond length	0.003
RMSD bond angle	0.487
Data reduction software	XDS (Jan 26, 2018 BUILT=20180409)
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.575	2.136
High resolution limit [Å]	2.099	2.099
Rmerge	0.076	0.146
Rpim	0.036	0.099
Number of reflections	15375	408
<I/σ(I)>	16.7	6.4
Completeness [%]	89.2	48.9
Redundancy	5.1	2.9
CC(1/2)	0.996	0.975

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	3.5	295.15	0.1 M Citric acid pH 3.5, 25% w/v Polyethylene glycol 3,350