Structure of PDB 6t77 Chain B

Receptor sequence
>6t77B (length=244) Species: 573 (Klebsiella pneumoniae) [Search protein sequence]
MSFEGKIALVTGASRGIGRAIAETLVARGAKVIGTATSESGAQAISDYLG
ANGKGLMLNVTDPASIESVLENVRAEFGEVDILVNNAGITRDNLLMRMKD
DEWNDIIETNLSSVFRLSKAVMRAMMKKRHGRIITIGSVVGTMGNAGQAN
YAAAKAGLIGFSKSLAREVASRGITVNVVAPGFIETDMTRALTDEQRAGT
LAAVPAGRLGTPNEIASAVAFLASDEASYITGETLHVNGGMYMV
3D structure
PDB6t77 A FabG inhibitor targeting an allosteric binding site inhibits several orthologs from Gram-negative ESKAPE pathogens.
ChainB
Resolution1.75 Å
3D
structure
Catalytic site residues are labeled in the structure
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Enzymatic activity
Catalytic site (original residue number in PDB) G16 S138 Y151
Catalytic site (residue number reindexed from 1) G16 S138 Y151
Enzyme Commision number 1.1.1.100: 3-oxoacyl-[acyl-carrier-protein] reductase.
Interaction with ligand
Site
#		 Ligand Ligand
chain		 Binding residues on receptor
(original residue number in PDB)		 Binding residues on receptor
(residue number reindexed from 1)		 Binding affinity
BS01 NAP B G12 S14 R15 T37 L58 N59 V60 N86 A87 G88 I89 I136 Y151 K155 P181 G182 I184 G12 S14 R15 T37 L58 N59 V60 N86 A87 G88 I89 I136 Y151 K155 P181 G182 I184
Gene Ontology
Molecular Function
GO:0004316 3-oxoacyl-[acyl-carrier-protein] reductase (NADPH) activity
GO:0016491 oxidoreductase activity
GO:0051287 NAD binding
Biological Process
GO:0006633 fatty acid biosynthetic process

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Molecular Function
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Biological Process
External links
PDB RCSB:6t77, PDBe:6t77, PDBj:6t77
PDBsum6t77
PubMed33388594
UniProtW9B6I8

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