6D2C

Structure of Ulvan lyase from Nonlaben Ulvanivorans- NLR48

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08B1-1
Synchrotron site	CLSI
Beamline	08B1-1
Temperature [K]	100
Detector technology	CCD
Collection date	2017-05-14
Detector	RAYONIX MX300HE
Wavelength(s)	0.980
Spacegroup name	P 21 21 21
Unit cell lengths	82.488, 102.117, 103.708
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.235 - 1.906
R-factor	0.1703
Rwork	0.169
R-free	0.20060
Structure solution method	SAD
RMSD bond length	0.015
RMSD bond angle	1.214
Data reduction software	XDS
Data scaling software	XDS
Phasing software	AutoSol
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.200	1.960
High resolution limit [Å]	1.910	1.910
Rmeas	0.143	1.250
Number of reflections	68867
<I/σ(I)>	10.01
Completeness [%]	99.8
Redundancy	7.6
CC(1/2)	0.997	0.642

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		282.15	0.49 M sodium phosphate monobasic monohydrate, 0.91 M potassium phosphate dibasic, pH 6.9