7BOB

Exo-beta-1,4-mannosidase Op5Man5 from Opitutaceae bacterium strain TAV5

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-10-20
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.826561
Spacegroup name	P 21 21 21
Unit cell lengths	102.140, 162.450, 168.180
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.867 - 2.200
R-factor	0.2013
Rwork	0.201
R-free	0.22730
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	Cryo-EM model (3.7 A)
RMSD bond length	0.008
RMSD bond angle	0.913
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX (1.15.2-3472)
Refinement software	PHENIX (1.15.2-3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.150	2.280
High resolution limit [Å]	2.200	2.200
Number of reflections	141664	17459
<I/σ(I)>	11.9	1.3
Completeness [%]	99.7	99.4
Redundancy	13.3	12.6
CC(1/2)	0.999	0.768

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.2	293	0.1 M phosphorus citrate (pH 4.2), 30 % (v/v) ethanol, and 5 % (w/v) polyethylene glycol 1000