6YV9

Mannosyltransferase PcManGT from Pyrobaculum calidifontis in complex with GDP-Man and Mn2+

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-10-07
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.95000
Spacegroup name	P 21 21 21
Unit cell lengths	51.465, 107.418, 163.845
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.413 - 2.700
R-factor	0.2195
Rwork	0.215
R-free	0.26480
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.014
RMSD bond angle	1.622
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((1.14_3260: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.100	2.800
High resolution limit [Å]	2.700	2.700
Number of reflections	25613	2547
<I/σ(I)>	16.3	2.2
Completeness [%]	99.5
Redundancy	12.5
CC(1/2)	0.999	0.799

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	295	0.1 mM HEPES (pH 7.5), 20% PEG 4000, 10% isopropanol, 10 mM MnCl2 and 2% 1,2,3-heptanetriol