Structure of PDB 7umt Chain a Binding Site BS02

Receptor Information
>7umt Chain a (length=271) Species: 10912 (Rotavirus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
NIPITGSMDTVYSNSTREEVFLTSTLCLYYPTEASTQISDGEWKDSLSQM
FLIKGWPTGSVYFKEYSNIVDFSVDPQLYCDYNLVLMKYDQSLELDMSEL
ADLILNEWLCNPMDITLYYYQQSGESNKWISMGSSCTVKVCPLNTQTLGI
GCQTTNVDSFETVAENEKLAIVDVVDGINHKINLTTTTCTIRNCKKLGPR
ENVAVIQVGGANILDITADPTTNPQIERMMRVNWKRWWQVFYTIVDYINQ
IVQVMSKRSRSLNSAAFYYRV
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 chain7umt Chain a Residue 403 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7umt Rotavirus VP4 Epitope of a Broadly Neutralizing Human Antibody Defined by Its Structure Bound with an Attenuated-Strain Virion.
Resolution3.4 Å
Binding residue
(original residue number in PDB)		D270 T272 D274 T277
Binding residue
(residue number reindexed from 1)		D215 T217 D219 T222
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding
Cellular Component
GO:0016020 membrane
GO:0019028 viral capsid
GO:0039621 T=13 icosahedral viral capsid
GO:0039624 viral outer capsid
GO:0044165 host cell endoplasmic reticulum
GO:0044166 host cell endoplasmic reticulum lumen

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Molecular Function
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Cellular Component
External links
PDB RCSB:7umt, PDBe:7umt, PDBj:7umt
PDBsum7umt
PubMed35924923
UniProtB1NP55

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