Het-PDB Navi2 (PDB: 4RLT)

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Ligands
Code	Name		Style	Show	Link
FSE	3,7,3',4'-tetrahydroxyflavone				PoSSuM
GOL	Glycerol				PoSSuM

Non-standard Residues
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Download interaction data: 4RLT

Code :

4RLT PDBj RCSB PDB PDBe

Header :

LYASE/LYASE INHIBITOR

Title :

Crystal Structure of (3R)-hydroxyacyl-ACP dehydratase HadAB hetero-dimer from Mycobacterium tuberculosis complexed with Fisetin

Release Data :

2015-10-21

Compound :

mol_id	molecule	chains	synonym
1	(3R)-hydroxyacyl-ACP dehydratase subunit HadA	A	Rv0635
	ec: 4.2.1.59

mol_id	molecule	chains	synonym
2	(3R)-hydroxyacyl-ACP dehydratase subunit HadB	B	Rv0636
	ec: 4.2.1.59

Source :

mol_id	organism_scientific	expression_system
1	Mycobacterium tuberculosis H37Rv (taxid:83332)	Escherichia coli BL21(DE3) (taxid:469008)
	gene: hadA, P425_00663, RVBD_0635 expression_system_vector_type: plasmid expression_system_plasmid: pRSFDuet-1

mol_id	organism_scientific	expression_system
2	Mycobacterium tuberculosis H37Rv (taxid:83332)	Escherichia coli BL21(DE3) (taxid:469008)
	gene: hadB, P425_00664, Rv0636, RVBD_0636 expression_system_vector_type: plasmid expression_system_plasmid: pGEX-6p-1

Authors :

Li, J., Dong, Y., Rao, Z.H.

Keywords :

double hotdog fold, (3R)-hydroxyacyl-ACP binding, LYASE-LYASE INHIBITOR complex

Exp. method :

X-RAY DIFFRACTION ( 2.049 Å )

Citation :

Molecular basis for the inhibition of beta-hydroxyacyl-ACP dehydratase HadAB complex from Mycobacterium tuberculosis by flavonoid inhibitors.

Dong, Y.,Qiu, X.,Shaw, N. et al.
(2015) Protein Cell 6 : 504 - 517

PDB ID: 4RLT