2FS5

Crystal structure of TDP-fucosamine acetyltransferase (WecD)- apo form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X8C
Synchrotron site	NSLS
Beamline	X8C
Temperature [K]	100
Detector technology	CCD
Collection date	2004-11-07
Detector	ADSC QUANTUM 4
Wavelength(s)	1.1
Spacegroup name	P 43 21 2
Unit cell lengths	84.837, 84.837, 155.610
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.800 - 1.950
R-factor	0.18343
Rwork	0.181
R-free	0.22310
Structure solution method	MAD
RMSD bond length	0.012
RMSD bond angle	1.306
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	SHELXD
Refinement software	REFMAC (5.2.0005)

Data quality characteristics

	Overall
Low resolution limit [Å]	32.800
High resolution limit [Å]	1.950
Number of reflections	40825
<I/σ(I)>	18.2
Completeness [%]	93.8
Redundancy	6.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.5		100 mM sodium acetate, 10 mM zinc sulfate, pH 4.5, VAPOR DIFFUSION, HANGING DROP
1	VAPOR DIFFUSION, HANGING DROP	4.5		100 mM sodium acetate, 10 mM zinc sulfate, pH 4.5, VAPOR DIFFUSION, HANGING DROP
1	VAPOR DIFFUSION, HANGING DROP	4.5		100 mM sodium acetate, 10 mM zinc sulfate, pH 4.5, VAPOR DIFFUSION, HANGING DROP