Structure of PDB 5qhl Chain B Binding Site BS01

Receptor Information
>5qhl Chain B (length=169) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GTHIDLLFHPPRAHLLTIKETIRKMIKEARKVIALVMDIFTDVDIFKEIV
EASTRGVSVYILLDESNFNHFLNMTEKQGCSVQRLRNIRVRTVKGQDYLS
KTGAKFHGKMEQKFLLVDCQKVMYGSYSYMWSFEKAHLSMVQIITGQLVE
SFDEEFRTLYARSCVPSSF
Ligand information
Ligand IDGQ7
InChIInChI=1S/C11H11NO2/c12-9-3-1-8(2-4-9)11-6-5-10(7-13)14-11/h1-6,13H,7,12H2
InChIKeyPGRYIWSQXZECGD-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385Nc1ccc(cc1)c2oc(CO)cc2
OpenEye OEToolkits 2.0.6c1cc(ccc1c2ccc(o2)CO)N
FormulaC11 H11 N O2
Name[5-(4-aminophenyl)furan-2-yl]methanol
ChEMBL
DrugBank
ZINCZINC000000188736
PDB chain5qhl Chain A Residue 308 [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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PDB5qhl PanDDA analysis group deposition of models with modelled events (e.g. bound ligands)
Resolution1.68 Å
Binding residue
(original residue number in PDB)		H126 R129 S256
Binding residue
(residue number reindexed from 1)		H9 R12 S139
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5qhl, PDBe:5qhl, PDBj:5qhl
PDBsum5qhl
PubMed
UniProtQ5T0W9|FA83B_HUMAN Protein FAM83B (Gene Name=FAM83B)

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