8VA3

Crystal structure of CapGH3b enzyme retrieved from capybara gut metagenome

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	293
Detector technology	PIXEL
Collection date	2020-03-10
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979320
Spacegroup name	P 21 21 21
Unit cell lengths	94.055, 105.352, 190.409
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.070 - 1.800
R-factor	0.1566
Rwork	0.155
R-free	0.18720
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5jp0
RMSD bond length	0.012
RMSD bond angle	1.092
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.20.1 4487:000)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.600	1.864
High resolution limit [Å]	1.800	1.800
Number of reflections	169561	13876
<I/σ(I)>	14.8
Completeness [%]	96.4
Redundancy	10.2
CC(1/2)	0.990	0.604

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	0.1 M HEPES pH 6.5, PEG6000 (8% v/v), Glycerol (10% v/v)