Structure of PDB 8qch Chain B Binding Site BS02

Receptor Information

>8qch Chain B (length=344) Species: 9606 (Homo sapiens)

TDFYSELPKVELHAHLNGSISSHTMKKLIAQKPDLKIHDQMTVIDKGKKR
TLEECFQMFQTIHQLTSSPEDILMVTKDVIKEFADDGVKYLELRSTPRRE
NATGMTKKTYVESILEGIKQSKQENLDIDVRYLIAVDRRGGPLVAKETVK
LAEEFFLSTEGTVLGLDLSGDPTVGQAKDFLEPLLEAKKAGLKLALHLSE
IPNQKKETQILLDLLPDRIGHGTFLNSGEGGSLDLVDFVRQHRIPLELCL
TSNVKSQTVPSYDQHHFGFWYSIAHPSVICTDDKGVFATHLSQEYQLAAE
TFNLTQSQVWDLSYESINYIFASDSTRSELRKKWNHLKPRVLHI

Ligand information

• Ligand ID: ZN
• InChI: InChI=1S/Zn/q+2
• InChIKey: PTFCDOFLOPIGGS-UHFFFAOYSA-N
• SMILES:
  CACTVS 3.341: [Zn++]
  ACDLabs 10.04
  OpenEye OEToolkits 1.5.0: [Zn+2]
• Formula: Zn
• Name: ZINC ION
• ChEMBL: CHEMBL1236970
• DrugBank: DB14532
• PDB chain: 8qch Chain B Residue 1002

Receptor-Ligand Complex Structure

Structure summary

• PDB: 8qch The activation chain of the broad-spectrum antiviral bemnifosbuvir at atomic resolution
• Resolution: 2.442 Å
• Binding residue (original residue number in PDB): H24 H26 H208 D293
• Binding residue (residue number reindexed from 1): H13 H15 H197 D282
• Annotation score: 1

Gene Ontology

Molecular Function

• GO:0004000 adenosine deaminase activity
• GO:0016787 hydrolase activity
• GO:0046872 metal ion binding
• GO:0062154 N6-methyl-AMP deaminase activity

Biological Process

• GO:0006154 adenosine catabolic process
• GO:0009117 nucleotide metabolic process
• GO:0046103 inosine biosynthetic process

Cellular Component

• GO:0005829 cytosol

External links

• PDB: RCSB:8qch, PDBe:8qch, PDBj:8qch
• PDBsum: 8qch
• PubMed: 39190717
• UniProt: Q6DHV7|ADAL_HUMAN Adenosine deaminase-like protein (Gene Name=ADAL)