Structure of PDB 7g9s Chain A Binding Site BS01

Receptor Information
>7g9s Chain A (length=435) Species: 64320 (Zika virus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MLKKKQLTVLDLHPGAGKTRRVLPEIVREAIKKRLRTVILAPTRVVAAEM
EEALRGLPVRYMTTAVNVTHSGTEIVDLMCHATFTSRLLQPIRVPNYNLN
IMDEAHFTDPSSIAARGYISTRVEMGEAAAIFMTATPPGTRDAFPDSNSP
IMDTEVEVPERAWSSGFDWVTDHSGKTVWFVPSVRNGNEIAACLTKAGKR
VIQLSRKTFETEFQKTKNQEWDFVITTDISEMGANFKADRVIDSRRCLKP
VILDGERVILAGPMPVTHASAAQRRGRIGRNPNKPGDEYMYGGGCAETDE
GHAHWLEARMLLDNIYLQDGLIASLYRPEADKVAAIEGEFKLRTEQRKTF
VELMKRGDLPVWLAYQVASAGITYTDRRWCFDGTTNNTIMEDSVPAEVWT
KYGEKRVLKPRWMDARVCSDHAALKSFKEFAAGKR
Ligand information
Ligand IDZUW
InChIInChI=1S/C11H13NO2/c1-9(13)12-6-7-14-11-5-3-2-4-10(11)8-12/h2-5H,6-8H2,1H3
InChIKeySCYVZWVJHDZYSQ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01CC(=O)N1Cc2ccccc2OCC1
CACTVS 3.385
OpenEye OEToolkits 2.0.7		CC(=O)N1CCOc2ccccc2C1
FormulaC11 H13 N O2
Name1-(2,3-dihydro-1,4-benzoxazepin-4(5H)-yl)ethan-1-one
ChEMBL
DrugBank
ZINCZINC000064541990
PDB chain7g9s Chain A Residue 705 [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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PDB7g9s PanDDA analysis group deposition
Resolution2.09 Å
Binding residue
(original residue number in PDB)		T570 P577
Binding residue
(residue number reindexed from 1)		T388 P395
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:0004386 helicase activity
GO:0005524 ATP binding

View graph for
Molecular Function
External links
PDB RCSB:7g9s, PDBe:7g9s, PDBj:7g9s
PDBsum7g9s
PubMed
UniProtQ32ZE1|POLG_ZIKV Genome polyprotein

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