Structure of PDB 7h29 Chain B Binding Site BS01

Receptor Information
>7h29 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 IDZ2F
InChIInChI=1S/C7H6N2O2S2/c8-13(10,11)5-1-2-6-7(3-5)12-4-9-6/h1-4H,(H2,8,10,11)
InChIKeyKRRLILAOGRCMFH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc2c(cc1S(=O)(=O)N)scn2
CACTVS 3.385N[S](=O)(=O)c1ccc2ncsc2c1
ACDLabs 12.01NS(=O)(=O)c1ccc2ncsc2c1
FormulaC7 H6 N2 O2 S2
Name1,3-benzothiazole-6-sulfonamide
ChEMBL
DrugBank
ZINCZINC000045235862
PDB chain7h29 Chain B Residue 202 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7h29 PanDDA analysis group deposition of ZIKV NS2B-NS3 protease
Resolution1.77 Å
Binding residue
(original residue number in PDB)		H51 Y130 S135 Y150 G151 Y161
Binding residue
(residue number reindexed from 1)		H36 Y115 S120 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:7h29, PDBe:7h29, PDBj:7h29
PDBsum7h29
PubMed
UniProtQ32ZE1|POLG_ZIKV Genome polyprotein

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