Structure of PDB 5ki9 Chain A Binding Site BS01

Receptor Information
>5ki9 Chain A (length=43) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EFELDRICGYGTARCRKKCRSQEYRIGRCPNTYACCLRKWDES
Ligand information
Ligand IDTFA
InChIInChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)
InChIKeyDTQVDTLACAAQTR-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01FC(F)(F)C(=O)O
CACTVS 3.370OC(=O)C(F)(F)F
OpenEye OEToolkits 1.7.0C(=O)(C(F)(F)F)O
FormulaC2 H F3 O2
Nametrifluoroacetic acid
ChEMBLCHEMBL506259
DrugBank
ZINCZINC000003860798
PDB chain5ki9 Chain A Residue 104 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5ki9 Human beta-Defensin 4: defensin without the "twist"
Resolution1.6 Å
Binding residue
(original residue number in PDB)		R16 R20
Binding residue
(residue number reindexed from 1)		R16 R20
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0045087 innate immune response
Cellular Component
GO:0005576 extracellular region

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Biological Process
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Cellular Component
External links
PDB RCSB:5ki9, PDBe:5ki9, PDBj:5ki9
PDBsum5ki9
PubMed
UniProtQ8WTQ1|D104A_HUMAN Beta-defensin 104 (Gene Name=DEFB104A)

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