6D3U

Complex structure of Ulvan lyase from Nonlaben Ulvanivorans- NLR48

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-07-09
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.979
Spacegroup name	P 21 21 21
Unit cell lengths	82.464, 102.664, 103.034
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.045 - 2.210
R-factor	0.1909
Rwork	0.190
R-free	0.22040
RMSD bond length	0.008
RMSD bond angle	1.091
Data reduction software	XDS
Data scaling software	XDS
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.045	2.270
High resolution limit [Å]	2.210	2.210
Rmeas	0.100	1.160
Number of reflections	44398
<I/σ(I)>	14.86
Completeness [%]	99.8
Redundancy	9.8
CC(1/2)	0.998	0.667

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