7T66

Co-crystal structure of Chaetomium glucosidase with compound UV-4

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-06-11
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9794
Spacegroup name	I 2 2 2
Unit cell lengths	135.587, 178.395, 180.038
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.780 - 2.190
R-factor	0.1894
Rwork	0.187
R-free	0.23140
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4j5t
RMSD bond length	0.010
RMSD bond angle	1.377
Data reduction software	HKL-2000 (v715)
Data scaling software	HKL-2000 (v715)
Phasing software	PHASER
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.780	2.270
High resolution limit [Å]	2.190	2.190
Rmerge	0.044	0.241
Rmeas	0.048	0.260
Rpim	0.018	0.098
Number of reflections	111323	10928
<I/σ(I)>	18.4
Completeness [%]	99.7	98.85
Redundancy	6.8	6.8
CC(1/2)	0.999	0.978

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	297	0.1 Bis Tris pH 6.5, 1.6-2.0 M Ammonium sulfate