8XRT

The crystal structure of a GH3 enzyme CcBgl3B

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-06-30
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97775
Spacegroup name	C 1 2 1
Unit cell lengths	164.594, 178.757, 267.336
Unit cell angles	90.00, 100.76, 90.00

Refinement procedure

Resolution	19.930 - 2.400
R-factor	0.1889
Rwork	0.189
R-free	0.22480
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.119
Refinement software	PHENIX ((1.18.2_3874: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.930	2.440
High resolution limit [Å]	2.400	2.400
Rmerge	0.090	0.716
Number of reflections	290928	14537
<I/σ(I)>	8.7
Completeness [%]	98.4
Redundancy	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	PEG