Structure of PDB 5mfw Chain B Binding Site BS01

Receptor Information
>5mfw Chain B (length=253) Species: 10116 (Rattus norvegicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TLIVTTILEEPYVMYRKSDKPLYGNDRFEGYCLDLLKELSNILGFLYDVK
LVPDGKYGAQNDKGEWNGMVKELIDHRADLAVAPLTITYVREKVIDFSKP
FMTLGISILYRKGTPIDSADDLAKQTKIEYGAVRDGSTMTFFKKSKISTY
EKMWAFMSSRQQSALVKNSDEGIQRVLTTDYALLMESTSIEYVTQRNCNL
TQIGGLIDSKGYGVGTPIGSPYRDKITIAILQLQEEGKLHMMKEKWWRGN
GCP
Ligand information
Ligand ID7M6
InChIInChI=1S/C9H10ClFN2O2S/c10-7-1-2-8-9(5-7)16(14,15)12-6-13(8)4-3-11/h1-2,5,12H,3-4,6H2
InChIKeyPDYLKRWZXXTAQJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.6c1cc2c(cc1Cl)S(=O)(=O)NCN2CCF
CACTVS 3.385FCCN1CN[S](=O)(=O)c2cc(Cl)ccc12
FormulaC9 H10 Cl F N2 O2 S
Name7-chloro-4-(2-fluoroethyl)-2,3-dihydro-1,2,4-benzothiadiazine 1,1-dioxide
ChEMBLCHEMBL581906
DrugBank
ZINCZINC000038314296
PDB chain5mfw 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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PDB5mfw Identification and Structure-Function Study of Positive Allosteric Modulators of Kainate Receptors.
Resolution2.1 Å
Binding residue
(original residue number in PDB)		P532 T535 K762 G763
Binding residue
(residue number reindexed from 1)		P100 T103 K210 G211
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:5mfw, PDBe:5mfw, PDBj:5mfw
PDBsum5mfw
PubMed28360094
UniProtP22756|GRIK1_RAT Glutamate receptor ionotropic, kainate 1 (Gene Name=Grik1)

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