Structure of PDB 8q8i Chain A Binding Site BS05

Receptor Information
>8q8i Chain A (length=279) Species: 10506 (Paramecium bursaria Chlorella virus 1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GAMKLAELTLESDDFITSDKLFNFCKSTGAKYVKTDFIKFRQYQYIVSNC
GWRDDTDVVFLENTPVLVTGHSDYDISEREIDIIRLPNIRAWFCQNRNIP
HPKVISFPLGITNKDEPNSEIHRIIGNTDRILEVSKTPKEIKNLVYMNIT
VKNFPEERQRIVDLYSDKSWVTIGKGEVSEEGHRKFLEDMYAHKFCFAPR
GNGIDTHRLWESLYLRTIPIVKKHIAMEQFTDLPILFVNDWENITEEYLN
EQYDIIMAKDWNLDKLKIDYWYQKILEYS
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 chain8q8i Chain A Residue 308 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8q8i AO75L in complex with a synthetic trisaccharide acceptor.
Resolution1.77 Å
Binding residue
(original residue number in PDB)
A4 R216
Binding residue
(residue number reindexed from 1)
A6 R216
Annotation score4
External links