Structure of PDB 8jev Chain A Binding Site BS02

Receptor Information
>8jev Chain A (length=556) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
YDDFHTIDWVREKCKDRERHRRINSKKKESAWEMTKSLYDAWSGWLVVTL
TGLASGALAGLIDIAADWMTDLKEGICLSALWYNHEQCCWPQWKTWAELI
IGQAEGPGSYIMNYIMYIFWALSFAFLAVSLVKVFAPYACGSGIPEIKTI
LSGFIIRGYLGKWTLMIKTITLVLAVASGLSLGKEGPLVHVACCCGNIFS
YLFPKYSTNEAKKREVLSAASAAGVSVAFGAPIGGVLFSLEEVSYYFPLK
TLWRSFFAALVAAFVLRSINPTPWYLFELFPFILLGVFGGLWGAFFIRAN
IAWCRRRKSTKFGKYPVLEVIIVAAITAVIAFPNPYTRLNTSELIKELFT
DCGYSAIWQLCLALIFKIIMTVFTFGIKVPSGLFIPSMAIGAIAGRIVGI
AVEQLAYYHHDWFIFKITPGLYAMVGAAACLGGVTRMTVSLVVIVFELTG
GLEYIVPLMAAVMTSKWVGDAFGREGIYEAHIRLNGYPFLDATTLAADVM
RPRSILDMSPFTVTDHTPMEIVVDIFRKLGLRQCLVTHNGRLLGIITKKD
ILRHMA
Ligand information
Ligand IDCL
InChIInChI=1S/ClH/h1H/p-1
InChIKeyVEXZGXHMUGYJMC-UHFFFAOYSA-M
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0		[Cl-]
FormulaCl
NameCHLORIDE ION
ChEMBL
DrugBankDB14547
ZINC
PDB chain8jev Chain A Residue 902 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB8jev Structural basis of adenine nucleotides regulation and neurodegenerative pathology in ClC-3 exchanger.
Resolution3.06 Å
Binding residue
(original residue number in PDB)		S239 Y630
Binding residue
(residue number reindexed from 1)		S142 Y478
Annotation score3
External links
PDB RCSB:8jev, PDBe:8jev, PDBj:8jev
PDBsum8jev
PubMed39107281
UniProtP51791|CLCN3_MOUSE H(+)/Cl(-) exchange transporter 3 (Gene Name=Clcn3)

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