Structure of PDB 5cu1 Chain A Binding Site BS01

Receptor Information
>5cu1 Chain A (length=197) Species: 246200 (Ruegeria pomeroyi DSS-3) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TDPAFQNLLAEFQALHAREPALAGFVALPDSLTPQPVTPVRIPPAALMES
DPDLTTTAYAAIRDAFIAAGAVAQWRLTYQGSRLGADFMDRFACYCLIGE
GGPFASDSLAAYVVYMPAGLYYPFHQHPAEEIYFILAGEAEFLMEGHPPR
RLGPGDHVFHPSGHPHATRTYDRPFMALVLWRGDLETAPVLTYPEGE
Ligand information
Ligand IDFE
InChIInChI=1S/Fe/q+3
InChIKeyVTLYFUHAOXGGBS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0		[Fe+3]
FormulaFe
NameFE (III) ION
ChEMBL
DrugBankDB13949
ZINC
PDB chain5cu1 Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5cu1 To be Published
Resolution2.3 Å
Binding residue
(original residue number in PDB)		H128 H130 E134 H169
Binding residue
(residue number reindexed from 1)		H125 H127 E131 H166
Annotation score1
Enzymatic activity
Enzyme Commision number 4.4.1.3: dimethylpropiothetin dethiomethylase.
Gene Ontology
Molecular Function
GO:0003674 molecular_function
GO:0016829 lyase activity
GO:0046872 metal ion binding
GO:0047869 dimethylpropiothetin dethiomethylase activity
Biological Process
GO:0008150 biological_process
Cellular Component
GO:0005575 cellular_component

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Biological Process
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Cellular Component
External links
PDB RCSB:5cu1, PDBe:5cu1, PDBj:5cu1
PDBsum5cu1
PubMed
UniProtQ5LT18|DDDQ_RUEPO Dimethylsulfonioproprionate lyase DddQ (Gene Name=dddQ)

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