Structure of PDB 7h20 Chain B Binding Site BS01

Receptor Information
>7h20 Chain B (length=156) Species: 64320 (Zika virus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GETTDGVYRVMTRRLLGSTQVGVGVMQEGVFHTMWHVTKGAALRSGEGRL
DPYWGDVKQDLVSYCGPWKLDAAWDGLSEVQLLAVPPGERAKNIQTLPGI
FKTKDGDIGAVALDYPAGTSGSPILDKCGRVIGLYGNGVVIKNGSYVSAI
TQGKRE
Ligand information
Ligand IDA1AJV
InChIInChI=1S/C7H11N2/c1-4-7-5-6-8(2)9(7)3/h4-6H,1H2,2-3H3/q+1
InChIKeyRGGYXESXCZRPIW-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01C[n+]1ccc(C=C)n1C
OpenEye OEToolkits 2.0.7Cn1c(cc[n+]1C)C=C
CACTVS 3.385Cn1c(C=C)cc[n+]1C
FormulaC7 H11 N2
Name3-ethenyl-1,2-dimethyl-pyrazole
ChEMBL
DrugBank
ZINC
PDB chain7h20 Chain B Residue 202 [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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PDB7h20 PanDDA analysis group deposition of ZIKV NS2B-NS3 protease
Resolution1.39 Å
Binding residue
(original residue number in PDB)		Y130 Y150 G151 Y161
Binding residue
(residue number reindexed from 1)		Y115 Y135 G136 Y146
Annotation score1
Enzymatic activity
Enzyme Commision number 2.1.1.56: mRNA (guanine-N(7))-methyltransferase.
2.1.1.57: methyltransferase cap1.
2.7.7.48: RNA-directed RNA polymerase.
3.4.21.91: flavivirin.
3.6.1.15: nucleoside-triphosphate phosphatase.
3.6.4.13: RNA helicase.
Gene Ontology
Molecular Function
GO:0003723 RNA binding
GO:0003724 RNA helicase activity
GO:0005524 ATP binding

View graph for
Molecular Function
External links
PDB RCSB:7h20, PDBe:7h20, PDBj:7h20
PDBsum7h20
PubMed
UniProtQ32ZE1|POLG_ZIKV Genome polyprotein

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