Structure of PDB 7h2d Chain B Binding Site BS01
Receptor Information
>7h2d Chain B (length=156) Species:
64320
(Zika virus) [
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GETTDGVYRVMTRRLLGSTQVGVGVMQEGVFHTMWHVTKGAALRSGEGRL
DPYWGDVKQDLVSYCGPWKLDAAWDGLSEVQLLAVPPGERAKNIQTLPGI
FKTKDGDIGAVALDYPAGTSGSPILDKCGRVIGLYGNGVVIKNGSYVSAI
TQGKRE
Ligand information
Ligand ID
GWP
InChI
InChI=1S/C7H9N3O/c8-6(11)5-3-9-7(10-5)4-1-2-4/h3-4H,1-2H2,(H2,8,11)(H,9,10)
InChIKey
ZIJDZTAYMWKMQH-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.385
NC(=O)c1c[nH]c(n1)C2CC2
OpenEye OEToolkits 2.0.6
c1c(nc([nH]1)C2CC2)C(=O)N
Formula
C7 H9 N3 O
Name
2-cyclopropyl-1~{H}-imidazole-4-carboxamide
ChEMBL
DrugBank
ZINC
ZINC000074942043
PDB chain
7h2d Chain B Residue 202 [
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Receptor-Ligand Complex Structure
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PDB
7h2d
PanDDA analysis group deposition of ZIKV NS2B-NS3 protease
Resolution
1.566 Å
Binding residue
(original residue number in PDB)
Y130 P131 S135 Y161
Binding residue
(residue number reindexed from 1)
Y115 P116 S120 Y146
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:7h2d
,
PDBe:7h2d
,
PDBj:7h2d
PDBsum
7h2d
PubMed
UniProt
Q32ZE1
|POLG_ZIKV Genome polyprotein
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