Structure of PDB 7zvv Chain B Binding Site BS03

Receptor Information
>7zvv Chain B (length=154) Species: 64320 (Zika virus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ETTDGVYRVMTRRLLGSTQVGVGVMQEGVFHTMWHVTKGAALRSGEGRLD
PYWGDVKQDLVSYCGPWKLDAAWDGLSEVQLLAVPPGERAKNIQTLPGIF
KTKDGDIGAVALDYPAGTSGSPILDKCGRVIGLYGNGVVIKNGSYVSAIT
QGKR
Ligand information
Ligand ID3CF
InChIInChI=1S/C10H10N2O2/c11-6-8-3-1-2-7(4-8)5-9(12)10(13)14/h1-4,9H,5,12H2,(H,13,14)/t9-/m0/s1
InChIKeyZHUOMTMPTNZOJE-VIFPVBQESA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.0c1cc(cc(c1)C#N)C[C@@H](C(=O)O)N
CACTVS 3.370N[C@@H](Cc1cccc(c1)C#N)C(O)=O
ACDLabs 12.01O=C(O)C(N)Cc1cccc(C#N)c1
OpenEye OEToolkits 1.7.0c1cc(cc(c1)C#N)CC(C(=O)O)N
CACTVS 3.370N[CH](Cc1cccc(c1)C#N)C(O)=O
FormulaC10 H10 N2 O2
Name3-cyano-L-phenylalanine
ChEMBLCHEMBL1230101
DrugBank
ZINCZINC000002556575
PDB chain7zvv Chain B Residue 205 [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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PDB7zvv Crystal Structure of Unlinked NS2B-NS3 Protease from Zika Virus in Complex with Inhibitor MI-2196
Resolution1.75 Å
Binding residue
(original residue number in PDB)		H51 D75 A132 G151 N152
Binding residue
(residue number reindexed from 1)		H35 D59 A116 G135 N136
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:7zvv, PDBe:7zvv, PDBj:7zvv
PDBsum7zvv
PubMed38809037
UniProtQ32ZE1|POLG_ZIKV Genome polyprotein

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