Structure of PDB 7ras Chain D Binding Site BS01

Receptor Information
>7ras Chain D (length=610) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KKKRLKKRIFAAVSEGCVEELRELLQDLQDLCRRRRGLDVPDFLMHKLTA
SDTGKTCLMKALLNINPNTKEIVRILLAFAEENDILDRFINAEYTEEAYE
GQTALNIAIERRQGDITAVLIAAGADVNAHAKGVFFNPKYQHEGFYFGET
PLALAACTNQPEIVQLLMENEQTDITSQDSRGNNILHALVTVAEDFKTQN
DFVKRMYDMILLRSGNWELETMRNNDGLTPLQLAAKMGKAEILKYILSRE
IKEKPLRSLSRKFTDWAYGPVSSSLYDLTNVDTTTDNSVLEIIVYNTNID
NRHEMLTLEPLHTLLHTKWKKFAKYMFFLSFCFYFFYNITLTLVSYYRHK
MSWLQLLGRMFVLIWATCISVKEGIAIFLLQSILSDAWFHFVFFVQAVLV
ILSVFLYLFAYKEYLACLVLAMALGWANMLAYTRGFQSMGMYSVMIQKVI
LHDVLKFLFVYILFLLGFGVALASLIGSFSDAVLELFKLTIGLGDLNIQQ
NSTYPILFLFLLITYVILTFVLLLNMLIALMGETVENVSKESERIWRLQR
ARTILEFEKMLPEWLRSRFRMGELCKVADEDFRLCLRINEVKWTEWKTHV
SFLNEDPGPI
Ligand information
Ligand IDA0O
InChIInChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3
InChIKeyMBRLOUHOWLUMFF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385COc1ccc2C=CC(=O)Oc2c1CC=C(C)C
OpenEye OEToolkits 2.0.6CC(=CCc1c(ccc2c1OC(=O)C=C2)OC)C
FormulaC15 H16 O3
Name7-methoxy-8-(3-methylbut-2-enyl)chromen-2-one
ChEMBLCHEMBL52229
DrugBank
ZINCZINC000000000566
PDB chain7ras Chain D Residue 901 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7ras Structural mechanism of TRPV3 channel inhibition by the plant-derived coumarin osthole.
Resolution3.64 Å
Binding residue
(original residue number in PDB)		S444 C496 I497 E501 M706
Binding residue
(residue number reindexed from 1)		S330 C368 I369 E373 M560
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005216 monoatomic ion channel activity
GO:0005261 monoatomic cation channel activity
GO:0005262 calcium channel activity
GO:0005515 protein binding
Biological Process
GO:0006811 monoatomic ion transport
GO:0009266 response to temperature stimulus
GO:0042636 negative regulation of hair cycle
GO:0055085 transmembrane transport
GO:0070588 calcium ion transmembrane transport
GO:0090280 positive regulation of calcium ion import
Cellular Component
GO:0005737 cytoplasm
GO:0005764 lysosome
GO:0005886 plasma membrane
GO:0016020 membrane
GO:0043235 receptor complex

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7ras, PDBe:7ras, PDBj:7ras
PDBsum7ras
PubMed34472684
UniProtQ8K424|TRPV3_MOUSE Transient receptor potential cation channel subfamily V member 3 (Gene Name=Trpv3)

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