9R4M

Crystal structure of CtGH76 from Chaetomium thermophilum in complex with mannose products form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-02-24
Detector	DECTRIS PILATUS4 X 2M
Wavelength(s)	1.0
Spacegroup name	P 31 2 1
Unit cell lengths	106.524, 106.524, 127.109
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	43.360 - 1.950
R-factor	0.1685
Rwork	0.167
R-free	0.19290
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.019
RMSD bond angle	1.544
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.360	2.020
High resolution limit [Å]	1.950	1.950
Rmerge	0.051	1.615
Rmeas	0.053
Number of reflections	60778	5872
<I/σ(I)>	31.3	1.94
Completeness [%]	99.2	96.74
Redundancy	19.9
CC(1/2)	1.000	0.938

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	3.6 M sodium formate 10% (v/v) glycerol