Structure of PDB 4adj Chain B Binding Site BS01

Receptor Information
>4adj Chain B (length=431) Species: 11041 (Rubella virus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EAFTYLCTAPGCATQTPVPVRLAGVRFESKIVDGGCFAPWDLEATGACIC
EIPTDVSCEGLGAWVPTAPCARIWNGTQRACTFWAVNAYSSGGYAQLASY
FNPGGSYYKQYHPTACEVEPAFGHSDAACWGFPTDTVMSVFALASYVQHP
HKTVRVKFHTETRTVWQLSVAGVSCNVTTEHPFCNTPHGQLEVQVPPDPG
DLVEYIMNNQQSRWGLGSPNCHGPDWASPVCQRHSPDCSRLVGATPERPR
LRLVDADDPLLRTAPGPGEVWVTPVIGSQARKCGLHIRAGPYGHATVEMP
EWIHAHTTSDPWHPPGPLGLKFKTVRPVALPRALAPPRNVRVTGCYQCGT
PALVEGLAPGGGNCHLTVNGEDVGAFPPGKFVTAALLNTPPPYQVSCGGE
SDRASARVIDPAAQSFTGVVYGTHTTAVSET
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain4adj Chain B Residue 1438 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4adj Functional and Evolutionary Insight from the Crystal Structure of Rubella Virus Protein E1.
Resolution1.94 Å
Binding residue
(original residue number in PDB)		N88 A89 D136 T137
Binding residue
(residue number reindexed from 1)		N87 A88 D135 T136
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Cellular Component
GO:0016020 membrane
GO:0019013 viral nucleocapsid

View graph for
Cellular Component
External links
PDB RCSB:4adj, PDBe:4adj, PDBj:4adj
PDBsum4adj
PubMed23292515
UniProtP08563|POLS_RUBVM Structural polyprotein

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