Structure of PDB 7h4p Chain A Binding Site BS01

Receptor Information
>7h4p 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 IDLGA
InChIInChI=1S/C4H5N3/c5-4-6-2-1-3-7-4/h1-3H,(H2,5,6,7)
InChIKeyLJXQPZWIHJMPQQ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341Nc1ncccn1
ACDLabs 10.04n1cccnc1N
OpenEye OEToolkits 1.5.0c1cnc(nc1)N
FormulaC4 H5 N3
NamePYRIMIDIN-2-AMINE
ChEMBLCHEMBL88580
DrugBank
ZINCZINC000000967472
PDB chain7h4p 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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PDB7h4p Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease
Resolution1.11 Å
Binding residue
(original residue number in PDB)		R55 H118
Binding residue
(residue number reindexed from 1)		R49 H112
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:7h4p, PDBe:7h4p, PDBj:7h4p
PDBsum7h4p
PubMed
UniProtQ65900|POLG_CX16G Genome polyprotein

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