Structure of PDB 7h2a Chain B Binding Site BS02
Receptor Information
>7h2a Chain B (length=156) Species:
64320
(Zika virus) [
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GETTDGVYRVMTRRLLGSTQVGVGVMQEGVFHTMWHVTKGAALRSGEGRL
DPYWGDVKQDLVSYCGPWKLDAAWDGLSEVQLLAVPPGERAKNIQTLPGI
FKTKDGDIGAVALDYPAGTSGSPILDKCGRVIGLYGNGVVIKNGSYVSAI
TQGKRE
Ligand information
Ligand ID
Z2Z
InChI
InChI=1S/C10H9NO2S/c1-14(12,13)9-6-2-4-8-5-3-7-11-10(8)9/h2-7H,1H3
InChIKey
RPUNNHCLJDHINC-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 12.01
CS(=O)(=O)c1cccc2cccnc12
OpenEye OEToolkits 2.0.7
CS(=O)(=O)c1cccc2c1nccc2
CACTVS 3.385
C[S](=O)(=O)c1cccc2cccnc12
Formula
C10 H9 N O2 S
Name
8-(methanesulfonyl)quinoline
ChEMBL
DrugBank
ZINC
ZINC000039140297
PDB chain
7h2a Chain B Residue 203 [
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Receptor-Ligand Complex Structure
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PDB
7h2a
PanDDA analysis group deposition of ZIKV NS2B-NS3 protease
Resolution
1.709 Å
Binding residue
(original residue number in PDB)
K54 G55 P67 Y68
Binding residue
(residue number reindexed from 1)
K39 G40 P52 Y53
Annotation score
1
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:7h2a
,
PDBe:7h2a
,
PDBj:7h2a
PDBsum
7h2a
PubMed
UniProt
Q32ZE1
|POLG_ZIKV Genome polyprotein
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