5VWT

Crystal structure of oxidized Aspergillus fumigatus UDP-galactopyranose mutase complexed with NADPH

Replaces:  4GDC

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	CCD
Collection date	2012-03-24
Detector	ADSC QUANTUM 315
Wavelength(s)	0.979
Spacegroup name	P 65 2 2
Unit cell lengths	218.292, 218.292, 319.216
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	162.662 - 2.750
R-factor	0.2043
Rwork	0.202
R-free	0.23920
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	3utf
RMSD bond length	0.009
RMSD bond angle	1.014
Data reduction software	XDS
Data scaling software	SCALA (3.3.16)
Phasing software	PHENIX
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	162.662	162.662	2.900
High resolution limit [Å]	2.750	8.700	2.750
Rmerge		0.035	0.885
Rmeas	0.147	0.037	0.967
Rpim	0.054	0.012	0.382
Total number of observations	851567
Number of reflections	116001
<I/σ(I)>	11.6	17.1	0.9
Completeness [%]	99.9	99.5	99.9
Redundancy	7.3	8.7	6.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	1.4 M ammonium sulfate, 0.1 M sodium acetate, pH 4.5