Het-PDB Navi2 (PDB: 4JFV)

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Ligands
Code	Name	Link
SO4	Sulfate ion	PoSSuM
IMD	Imidazole	PoSSuM
H57	(3alpha)-[({2-[(2s,3s,4r,5s)-3,4-dihydroxy-5-methylpyrrolidin-2-yl]ethyl}amino)methyl]ferrocene	PoSSuM

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Download interaction data: 4JFV

Code :

4JFV PDBj RCSB PDB PDBe

Header :

HYDROLASE/HYDROLASE INHIBITOR

Title :

Crystal structure of a bacterial fucosidase with iminosugar inhibitor (2S,3S,4R,5S)-2-[N-(methylferrocene)]aminoethyl-5-methylpyrrolidine-3,4-diol

Release Data :

2013-09-18

Compound :

mol_id	molecule	chains
1	alpha-L-fucosidase	A,B,C,D
	fragment: RESIDUES 35-484

Source :

mol_id	organism_scientific	expression_system
1	Bacteroides thetaiotaomicron (taxid:226186)	Escherichia coli (taxid:469008)
	strain: VPI-5482 expression_system_strain: BL21(DE3) expression_system_vector_type: plasmid expression_system_plasmid: pET-YSBLIC

Authors :

Wright, D.W., Davies, G.J.

Keywords :

alpha-L-fucosidase, HYDROLASE-HYDROLASE INHIBITOR complex

Exp. method :

X-RAY DIFFRACTION ( 1.8800 Å )

Citation :

alpha-L-fucosidase inhibition by pyrrolidine-ferrocene hybrids: rationalization of ligand-binding properties by structural studies.

Hottin, A.,Wright, D.W.,Steenackers, A. et al.
(2013) Chemistry 19 : 9526 - 9533

PDB ID: 4JFV