Structure of PDB 4llh Chain C Binding Site BS02

Receptor Information
>4llh Chain C (length=490) Species: 196627 (Corynebacterium glutamicum ATCC 13032) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SLNWSVIVPALVIVLATVVWGIGFKDSFTNFASSALSAVVDNLGWAFILF
GTVFVFFIVVIAASKFGTIRLGRIDEAPEFRTVSWISMMFAAGMGIDLMF
YGTTEPLTFYRNGVPGHDEHNVGVAMSTTMFHWTLHPWAIYAIVGLAIAY
STFRVGRKQLLSSAFVPLIGEKGAEGWLGKLIDILAIIATVFGTACSLGL
GALQIGAGLSAANIPSDWTIVGIVSVLTLAFIFSAISGIQYLSNANMVLA
ALLAIFVFVVGPTVSILNLLPGSIGNYLSNFFQMAGRTAMSADGTAGEWL
GSWTIFYWAWWISWSPFVGMFLARISRGRSIREFILGVLLVPAGVSTVWF
SIFGGTAIVFEQNGESIWGDGAAEEQLFGLLHALPGGQIMGIIAMILLGT
FFITSADSASTVMGTMSQHGQLEANKWVTAAWGVATAAIGLTLLLSGGDN
ALSNLQNVTIVAATPFLFVVIGLMFALVKDLSNDVIYLEY
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 chain4llh Chain C Residue 603 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4llh Substrate-bound outward-open state of the betaine transporter BetP provides insights into Na(+) coupling.
Resolution2.8 Å
Binding residue
(original residue number in PDB)		D153 W377
Binding residue
(residue number reindexed from 1)		D97 W314
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0015293 symporter activity
GO:0022857 transmembrane transporter activity
GO:0042802 identical protein binding
GO:0046872 metal ion binding
Biological Process
GO:0055085 transmembrane transport
GO:0071705 nitrogen compound transport
Cellular Component
GO:0005886 plasma membrane
GO:0016020 membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:4llh, PDBe:4llh, PDBj:4llh
PDBsum4llh
PubMed25023443
UniProtP54582|BETP_CORGL Glycine betaine transporter BetP (Gene Name=betP)

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