Structure of PDB 5mfv Chain B Binding Site BS01

Receptor Information
>5mfv Chain B (length=251) Species: 10116 (Rattus norvegicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TLIVTTILEEPYVMYRKSDKPLYGNDRFEGYCLDLLKELSNILGFLYDVK
LVPDGKYGAQNGEWNGMVKELIDHRADLAVAPLTITYVREKVIDFSKPFM
TLGISILYRKGTPIDSADDLAKQTKIEYGAVRDGSTMTFFKKSKISTYEK
MWAFMSSRQQSALVKNSDEGIQRVLTTDYALLMESTSIEYVTQRNCNLTQ
IGGLIDSKGYGVGTPIGSPYRDKITIAILQLQEEGKLHMMKEKWWRGNGC
P
Ligand information
Ligand ID5PX
InChIInChI=1S/C10H12N2O3S/c13-8-3-4-9-10(5-8)16(14,15)11-6-12(9)7-1-2-7/h3-5,7,11,13H,1-2,6H2
InChIKeyOMEAYSCNDLQLNC-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385Oc1ccc2N(CN[S](=O)(=O)c2c1)C3CC3
OpenEye OEToolkits 1.7.6c1cc2c(cc1O)S(=O)(=O)NCN2C3CC3
FormulaC10 H12 N2 O3 S
Name4-Cyclopropyl-3,4-dihydro-7-hydroxy-2H-1,2,4-benzothiadiazine 1,1-dioxide;
BPAM-521
ChEMBL
DrugBank
ZINCZINC000118234308
PDB chain5mfv Chain A Residue 901 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5mfv Identification and Structure-Function Study of Positive Allosteric Modulators of Kainate Receptors.
Resolution2.181 Å
Binding residue
(original residue number in PDB)		P532 T535 K762 G763
Binding residue
(residue number reindexed from 1)		P98 T101 K208 G209
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0015276 ligand-gated monoatomic ion channel activity
Cellular Component
GO:0016020 membrane

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Molecular Function
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Cellular Component
External links
PDB RCSB:5mfv, PDBe:5mfv, PDBj:5mfv
PDBsum5mfv
PubMed28360094
UniProtP22756|GRIK1_RAT Glutamate receptor ionotropic, kainate 1 (Gene Name=Grik1)

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