Structure of PDB 8fym Chain I Binding Site BS02

Receptor Information
>8fym Chain I (length=126) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QVQLQQSGTDLVRPGTSVKVSCKASGYAFTTYFIEWVKQRPGQGLEWIGV
INPGSGIPNYNEMFKGKATLTADKSSSTAYLHLSSLTSDDSAVYFCARAP
YYYGSSYYYFDVWGAGTTVTVSSAST
Ligand information
Ligand ID1HC
InChIInChI=1S/C3H5NO/c1-2-3(4)5/h2H,1H2,(H2,4,5)
InChIKeyHRPVXLWXLXDGHG-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.6C=CC(=O)N
ACDLabs 12.01O=C(\C=C)N
CACTVS 3.370NC(=O)C=C
FormulaC3 H5 N O
Nameprop-2-enamide
ChEMBLCHEMBL348107
DrugBank
ZINCZINC000000901075
PDB chain8fym Chain I Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8fym Crystal structure of Fab235 in complex with MPER peptide
Resolution2.45 Å
Binding residue
(original residue number in PDB)
K38 E46
Binding residue
(residue number reindexed from 1)
K38 E46
Annotation score1
External links