6C58

Human UDP-Glucose Dehydrogenase A225L substitutuion with UDP-xylose bound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	77
Detector technology	CCD
Collection date	2015-11-14
Detector	RAYONIX MX300-HS
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	93.520, 194.990, 109.540
Unit cell angles	90.00, 110.71, 90.00

Refinement procedure

Resolution	51.288 - 2.198
R-factor	0.2124
Rwork	0.209
R-free	0.24440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ptz
RMSD bond length	0.005
RMSD bond angle	0.557
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	51.288	2.250
High resolution limit [Å]	2.198	2.198
Rmeas	0.154	1.119
Number of reflections	178670	13090
<I/σ(I)>	5.95
Completeness [%]	96.3	95.8
Redundancy	2.82	2.76
CC(1/2)	0.992	0.436

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.4	293	10% PEG3350, 16% 1,5-pentanediol, 100 mM HEPES