6GL0

Structure of ZgEngAGH5_4 in complex with a cellotriose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-09-24
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97858
Spacegroup name	P 32
Unit cell lengths	84.574, 84.574, 117.661
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.870 - 2.200
R-factor	0.17659
Rwork	0.174
R-free	0.22076
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ndz
RMSD bond length	0.013
RMSD bond angle	1.495
Data reduction software	XDS
Data scaling software	Aimless (0.5.32)
Phasing software	PHASER
Refinement software	REFMAC (5.8.0189)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	45.870	45.870	2.050
High resolution limit [Å]	2.000	8.930	2.000
Rmerge	0.062	0.029	0.824
Rmeas	0.076	0.036	1.013
Rpim	0.044	0.020	0.583
Number of reflections	63507	704	4502
<I/σ(I)>	12.9
Completeness [%]	99.3	97.6	95.1
Redundancy	2.9	2.9	2.8
CC(1/2)	0.998	0.998	0.616

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	293	24-24.5% PEG 3350, 160 mM MgCl2, 0.1 M Bis Tris pH 5.5