Structure of PDB 6t62 Chain B

Receptor sequence
>6t62B (length=230) Species: 470 (Acinetobacter baumannii) [Search protein sequence]
ERKVALVTGASRGIGAAIAQQLIQDGYFVVGTATSESGAQKLTDSFGEQG
AGLALDVRNLDEIEAVVSHIEQNYGPVLVLVNNAGITKDNLLLRMSEDDW
DDILNIHLKAVYRLSKRVLKGMTKARFGRIINISSVVAHFANPGQANYSA
AKAGIEAFSRSLAKEMGSRQITVNSVAPGFIATKKMSDQVALNRLGEPQD
IANAVSFLASDKAGYITGTVLHVNGGLYMA
3D structure
PDB6t62 A FabG inhibitor targeting an allosteric binding site inhibits several orthologs from Gram-negative ESKAPE pathogens.
ChainB
Resolution1.8 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) G13 S135 Y148
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 I17 T37 D59 V60 N86 A87 G88 I89 I136 S138 Y151 K155 P181 G182 I184 G9 S11 R12 I14 T34 D56 V57 N83 A84 G85 I86 I133 S135 Y148 K152 P178 G179 I181
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
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:6t62, PDBe:6t62, PDBj:6t62
PDBsum6t62
PubMed33388594
UniProtV5VHN7

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