Structure of PDB 6hck Chain A Binding Site BS01

Receptor Information
>6hck Chain A (length=232) Species: 169963 (Listeria monocytogenes EGD-e) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MNAQAEEFKKYLETNGIKPKQFHKKELIFNQWDPQEYCIFLYDGITKLTS
ISENGTIMNLQYYKGAFVIMSGFIDTETSVGYYNLEVISEQATAYVIKIN
ELKELLSKNLTHFFYVFQTLQKQVSYSLAKFNDFSINGKLGSICGQLLIL
TYVYGKETPDGIKITLDNLTMQELIAHSSAVSRIISKLKQEKVIVYKNSC
FYVQNLDYLKRYAPKLDEWFYLACPATWGKLN
Ligand information
Ligand IDLEU
InChIInChI=1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1
InChIKeyROHFNLRQFUQHCH-YFKPBYRVSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0CC(C)C[C@@H](C(=O)O)N
CACTVS 3.341CC(C)C[C@H](N)C(O)=O
OpenEye OEToolkits 1.5.0CC(C)CC(C(=O)O)N
ACDLabs 10.04O=C(O)C(N)CC(C)C
CACTVS 3.341CC(C)C[CH](N)C(O)=O
FormulaC6 H13 N O2
NameLEUCINE
ChEMBLCHEMBL291962
DrugBankDB00149
ZINCZINC000003645145
PDB chain6hck Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB6hck Control of Bacterial Virulence through the Peptide Signature of the Habitat.
Resolution2.7 Å
Binding residue
(original residue number in PDB)		K64 Y126 L150
Binding residue
(residue number reindexed from 1)		K64 Y126 L150
Annotation score4
Binding affinityPDBbind-CN: -logKd/Ki=4.60,Kd~25uM
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003677 DNA binding
GO:0003700 DNA-binding transcription factor activity
Biological Process
GO:0006355 regulation of DNA-templated transcription
Cellular Component
GO:0005829 cytosol

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6hck, PDBe:6hck, PDBj:6hck
PDBsum6hck
PubMed30759392
UniProtP22262|PRFA_LISMO Listeriolysin regulatory protein (Gene Name=prfA)

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