11TN

Candida glabrata Glycogen Debranching Enzyme (GDE) in complex with Miglustat

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	77
Detector technology	PIXEL
Collection date	2024-07-26
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1
Spacegroup name	C 2 2 21
Unit cell lengths	159.078, 199.274, 254.213
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	127.106 - 3.236
Rwork	0.235
R-free	0.27350
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.858
Data reduction software	autoPROC
Data scaling software	STARANISO
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0431 (refmacat 0.4.105))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	127.106	3.595
High resolution limit [Å]	3.200	3.236
Number of reflections	64558	36604
<I/σ(I)>	6.2
Completeness [%]	93.5
Redundancy	14.2
CC(1/2)	0.980	0.527

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	295	0.1 M MES (pH 7), 7% v/v Tacsimate (pH 7), 20% w/v PEG MME 5K