Structure of PDB 7h34 Chain A Binding Site BS01

Receptor Information
>7h34 Chain A (length=140) Species: 31704 (Coxsackievirus A16) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARC
DCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSE
PGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEE
Ligand information
Ligand IDPK4
InChIInChI=1S/C8H10FNO2S/c1-6-4-3-5-7(8(6)9)13(11,12)10-2/h3-5,10H,1-2H3
InChIKeyPXJRMCHXJXWNJG-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.6Cc1cccc(c1F)S(=O)(=O)NC
ACDLabs 12.01CNS(c1c(c(C)ccc1)F)(=O)=O
CACTVS 3.385CN[S](=O)(=O)c1cccc(C)c1F
FormulaC8 H10 F N O2 S
Name2-fluoro-N,3-dimethylbenzene-1-sulfonamide
ChEMBL
DrugBank
ZINCZINC000273215815
PDB chain7h34 Chain A Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7h34 Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease
Resolution1.39 Å
Binding residue
(original residue number in PDB)		P79 S80 L81 S96 H97
Binding residue
(residue number reindexed from 1)		P73 S74 L75 S90 H91
Annotation score1
Enzymatic activity
Enzyme Commision number 2.7.7.48: RNA-directed RNA polymerase.
3.4.22.28: picornain 3C.
3.4.22.29: picornain 2A.
3.6.1.15: nucleoside-triphosphate phosphatase.
Gene Ontology
Molecular Function
GO:0008233 peptidase activity
Biological Process
GO:0006508 proteolysis
GO:0016032 viral process

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Molecular Function
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Biological Process
External links
PDB RCSB:7h34, PDBe:7h34, PDBj:7h34
PDBsum7h34
PubMed
UniProtQ65900|POLG_CX16G Genome polyprotein

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