Structure of PDB 3iwf Chain A Binding Site BS01

Receptor Information
>3iwf Chain A (length=89) Species: 176280 (Staphylococcus epidermidis ATCC 12228) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MPNILYKIDNQYPYFTKNEKKIAQFILNYPHKVVNMTSQEIANQLETSST
SIIRLSKKVTPGGFNELKTRLSKFLPKEVTQYNNKLHSR
Ligand information
Ligand IDMXE
InChIInChI=1S/C3H8O2/c1-5-3-2-4/h4H,2-3H2,1H3
InChIKeyXNWFRZJHXBZDAG-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341
OpenEye OEToolkits 1.5.0		COCCO
ACDLabs 10.04OCCOC
FormulaC3 H8 O2
Name2-METHOXYETHANOL
ChEMBLCHEMBL444144
DrugBankDB02806
ZINCZINC000001591817
PDB chain3iwf Chain A Residue 111 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3iwf The Crystal Structure of the N-terminal domain of a RpiR Transcriptional Regulator from Staphylococcus epidermidis to 1.4A
Resolution1.4 Å
Binding residue
(original residue number in PDB)		Q39 A42 N43
Binding residue
(residue number reindexed from 1)		Q39 A42 N43
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003677 DNA binding
GO:0003700 DNA-binding transcription factor activity
GO:0097367 carbohydrate derivative binding
Biological Process
GO:0006355 regulation of DNA-templated transcription

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Molecular Function
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Biological Process
External links
PDB RCSB:3iwf, PDBe:3iwf, PDBj:3iwf
PDBsum3iwf
PubMed
UniProtA0A0H2VHQ2

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