Structure of PDB 5nxy Chain C Binding Site BS01

Receptor Information
>5nxy Chain C (length=267) Species: 1423 (Bacillus subtilis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QTIKIGAQSMSESEIIASMQGQLIEHHTDLKTTTIKNLGQQALMNGEIDI
AATRYTGDALTGTLRMEPEKDPDKALALTQREFKKRYDLKWYDSYGFDNT
YAFTVSKELADQYHLETVSDVKKWAPQLKLGVDNYWMKLKGNGYQDFTKT
YGMTFGGTYPMQIGLVYDAVKSGKMDIVLAYSTDGRIKSYGLKMLKDDKQ
FFPPYDCSPVVPEKVLKEHPELEGIIKKMLGKIDTATMQELNYEVDGNLK
EPSVVAKEYLEKHRYFE
Ligand information
Ligand ID1Y8
InChIInChI=1S/C5H15AsO/c1-6(2,3)4-5-7/h6-7H,4-5H2,1-3H3
InChIKeyCIHXLIBMYUSRLN-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01OCC[As](C)(C)C
CACTVS 3.385
OpenEye OEToolkits 1.7.6		C[As](C)(C)CCO
FormulaC5 H14 As O
Name2-(trimethyl-lambda~5~-arsanyl)ethanol
ChEMBL
DrugBank
ZINC
PDB chain5nxy Chain C Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5nxy Arsenobetaine: an ecophysiologically important organoarsenical confers cytoprotection against osmotic stress and growth temperature extremes.
Resolution1.9 Å
Binding residue
(original residue number in PDB)		Y63 D66 N107 Y189 Y213
Binding residue
(residue number reindexed from 1)		Y55 D58 N99 Y181 Y205
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0022857 transmembrane transporter activity
Biological Process
GO:0006865 amino acid transport
GO:0055085 transmembrane transport
Cellular Component
GO:0005886 plasma membrane
GO:0043190 ATP-binding cassette (ABC) transporter complex

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:5nxy, PDBe:5nxy, PDBj:5nxy
PDBsum5nxy
PubMed29159878
UniProtQ45462|OPUBC_BACSU Choline-binding protein (Gene Name=opuBC)

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