Structure of PDB 8xdu Chain A Binding Site BS01

Receptor Information
>8xdu Chain A (length=242) Species: 272140 (Lycoris longituba) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GPGMGASQDDYALIHKNILHSEDLLKYILETSVYPREHEQLKGLREVTEK
HEWSSALVAADEGLFLSMLLKLMNAKRTIEIGVYTGYSLLTTALALPEDG
KITAIDVNKSYFEIGLPFIQKAGVEHKINFIESEALPVLDQMLQEMKEED
LYDFAFVDADKPNYANYHERLVKLVRVGGAIVYDNTLWFGTVAFPEYPGL
HPEEEECRVSFRNLNKLLAADPRVEISQVSIGDGLTICRRLY
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 chain8xdu Chain A Residue 502 [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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PDB8xdu Structure-Based Catalytic Mechanism of Amaryllidaceae O-Methyltransferases
Resolution1.92 Å
Binding residue
(original residue number in PDB)		D155 D181 N182
Binding residue
(residue number reindexed from 1)		D158 D184 N185
Annotation score1
External links