Structure of PDB 7g9p Chain A Binding Site BS01

Receptor Information
>7g9p 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 IDZUC
InChIInChI=1S/C13H11FN2O2/c1-8-3-2-4-11(17)12(8)16-13(18)9-5-6-15-7-10(9)14/h2-7,17H,1H3,(H,16,18)
InChIKeyPDGRBWXZTBUJKY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385Cc1cccc(O)c1NC(=O)c2ccncc2F
ACDLabs 12.01O=C(Nc1c(C)cccc1O)c1ccncc1F
OpenEye OEToolkits 2.0.7Cc1cccc(c1NC(=O)c2ccncc2F)O
FormulaC13 H11 F N2 O2
Name3-fluoro-N-(2-hydroxy-6-methylphenyl)pyridine-4-carboxamide
ChEMBL
DrugBank
ZINCZINC000097233745
PDB chain7g9p 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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PDB7g9p PanDDA analysis group deposition
Resolution1.743 Å
Binding residue
(original residue number in PDB)		Y243 M244 T245 V250 H252
Binding residue
(residue number reindexed from 1)		Y61 M62 T63 V68 H70
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:7g9p, PDBe:7g9p, PDBj:7g9p
PDBsum7g9p
PubMed
UniProtQ32ZE1|POLG_ZIKV Genome polyprotein

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