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BioLiP

Structure of PDB 6wh4 Chain C Binding Site BS03

Receptor Information
>6wh4 Chain C (length=375) Species: 562,9606 [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LHLQEKNWSALLTAVVIILTIAGNILVIMAVSLEKKLQNATNYFLMSLAI
ADMLLGFLVMPVSMLTILYGYRWPLPSKLCAVWIYLDVLFSTASIMHLCA
ISLDRYVAIQNHSRFNSRTKAFLKIIAVWTISVGISMPIPVFQDDSKVFK
EGSCLLADDNFVLIGSFVSFFIPATIMVITYFLTIKSLQKEAADLEDNWE
TLNDNLKVIEKADNAAQVKDALTKMRAAALDAQKATPPDSPEMKDFRHGF
DILVGQIDDALKLKVKEAQAAAEQLKTTRNAYIQKYLTMQSISNEQKACK
VLGIVFFLFVVMWCPFFITNIMAVICKESCNEDVIGALLNVFVWIGYASS
AVNPLVYTLFNKTYRSAFSRYIQCQ
Ligand information
Ligand IDNDS
InChIInChI=1S/C7H17NO3S/c1-4-8(2,3)6-5-7-12(9,10)11/h4-7H2,1-3H3
InChIKeyNNCRHRDBFDCWPA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341CC[N+](C)(C)CCC[S]([O-])(=O)=O
OpenEye OEToolkits 1.5.0CC[N+](C)(C)CCCS(=O)(=O)[O-]
ACDLabs 10.04[O-]S(=O)(=O)CCC[N+](C)(CC)C
FormulaC7 H17 N O3 S
NameETHYL DIMETHYL AMMONIO PROPANE SULFONATE
ChEMBLCHEMBL1234674
DrugBankDB02618
ZINC
PDB chain6wh4 Chain C Residue 1205 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6wh4 Structure of a Hallucinogen-Activated Gq-Coupled 5-HT 2A Serotonin Receptor
Resolution3.4 Å
Binding residue
(original residue number in PDB)		N1011 Y1101 K1104
Binding residue
(residue number reindexed from 1)		N203 Y282 K285
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0004930 G protein-coupled receptor activity
GO:0004993 G protein-coupled serotonin receptor activity
GO:0005506 iron ion binding
GO:0009055 electron transfer activity
GO:0020037 heme binding
GO:0046872 metal ion binding
Biological Process
GO:0007186 G protein-coupled receptor signaling pathway
GO:0022900 electron transport chain
Cellular Component
GO:0005886 plasma membrane
GO:0016020 membrane
GO:0042597 periplasmic space

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Cellular Component
External links
PDB RCSB:6wh4, PDBe:6wh4, PDBj:6wh4
PDBsum6wh4
PubMed
UniProtP0ABE7|C562_ECOLX Soluble cytochrome b562 (Gene Name=cybC);
P28223|5HT2A_HUMAN 5-hydroxytryptamine receptor 2A (Gene Name=HTR2A)

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