Structure of PDB 5qhi Chain B Binding Site BS01

Receptor Information
>5qhi 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 IDGOJ
InChIInChI=1S/C6H8N2O2/c1-2-10-6(9)5-3-7-8-4-5/h3-4H,2H2,1H3,(H,7,8)
InChIKeyKACZQOKEFKFNDB-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385
OpenEye OEToolkits 2.0.6
CCOC(=O)c1c[nH]nc1
FormulaC6 H8 N2 O2
Nameethyl 1~{H}-pyrazole-4-carboxylate
ChEMBLCHEMBL4461273
DrugBank
ZINCZINC000000409316
PDB chain5qhi Chain B Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB5qhi PanDDA analysis group deposition of models with modelled events (e.g. bound ligands)
Resolution1.73 Å
Binding residue
(original residue number in PDB)
Y177 D270 F273
Binding residue
(residue number reindexed from 1)
Y60 D153 F156
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5qhi, PDBe:5qhi, PDBj:5qhi
PDBsum5qhi
PubMed
UniProtQ5T0W9|FA83B_HUMAN Protein FAM83B (Gene Name=FAM83B)

[Back to BioLiP]