Structure of PDB 7thr Chain A Binding Site BS02

Receptor Information
>7thr Chain A (length=521) Species: 57579 (Adeno-associated virus - 4) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GVGNASGDWHCDSTWSEGHVTTTSTRTWVLPTYNNHLYKRLGESLQSNTY
NGFSTPWGYFDFNRFHCHFSPRDWQRLINNNWGMRPKAMRVKIFNIQVKE
VTTSNGETTVANNLTSTVQIFADSSYELPYVMDAGQEGSLPPFPNDVFMV
PQYGYCGLVTGNTSQQQTDRNAFYCLEYFPSQMLRTGNNFEITYSFEKVP
FHSMYAHSQSLDRLMNPLIDQYLWGLQSTTTGTTLNAGTATTNFTKLRPT
NFSNFKKNWLPGPSIKQQGFSKTANQNYKIPATGSDSLIKYETHSTLDGR
WSALTPGPPMATAGPADSKFSNSQLIFAGPKQNGNTATVPGTLIFTSEEE
LAATNATDTDMWGNLPGGDQSNSNLPTVDRLTALGAVPGMVWQNRDIYYQ
GPIWAKIPHTDGHFHPSPLIGGFGLKHPPPQIFIKNTPVPANPATTFSST
PVNSFITQYSTGQVSVQIDWEIQKERSKRWNPEVQFTSNYGQQNSLLWAP
DAAGKYTEPRAIGTRYLTHHL
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain7thr Chain A Residue 2001 [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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PDB7thr Cryo-EM structure of adeno-associated virus 4 at 2.2 angstrom resolution.
Resolution2.21 Å
Binding residue
(original residue number in PDB)		Y418 H420
Binding residue
(residue number reindexed from 1)		Y205 H207
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005198 structural molecule activity
Cellular Component
GO:0019028 viral capsid
GO:0039615 T=1 icosahedral viral capsid

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Molecular Function
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Cellular Component
External links
PDB RCSB:7thr, PDBe:7thr, PDBj:7thr
PDBsum7thr
PubMed36762860
UniProtO41855

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