Structure of PDB 5qho Chain A Binding Site BS01

Receptor Information
>5qho Chain A (length=164) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GGTHIDLLFHPPRAHLLTIKETIRKMIKEARKVIALVMDIFTDVDIFKEI
VEASTRGVSVYILLDESNFNHFLNMTEKQGCSVQRLRNIRVRTVKGQDYF
HGKMEQKFLLVDCQKVMYGSYSYMWSFEKAHLSMVQIITGQLVESFDEEF
RTLYARSCVPSSFA
Ligand information
Ligand IDGOY
InChIInChI=1S/C11H20N2O/c14-11(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10H2
InChIKeySNOJOKOVTYPHMC-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.6C1CCN(CC1)C(=O)N2CCCCC2
CACTVS 3.385O=C(N1CCCCC1)N2CCCCC2
FormulaC11 H20 N2 O
Namedi(piperidin-1-yl)methanone
ChEMBLCHEMBL11960
DrugBank
ZINCZINC000000155163
PDB chain5qho Chain A Residue 203 [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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PDB5qho PanDDA analysis group deposition of models with modelled events (e.g. bound ligands)
Resolution1.66 Å
Binding residue
(original residue number in PDB)
V35 L119 C122 D156 R160 Y163
Binding residue
(residue number reindexed from 1)
V33 L110 C113 D147 R151 Y154
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5qho, PDBe:5qho, PDBj:5qho
PDBsum5qho
PubMed
UniProtQ5T0W9|FA83B_HUMAN Protein FAM83B (Gene Name=FAM83B)

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