Structure of PDB 9etk Chain A Binding Site BS03

Receptor Information
>9etk Chain A (length=280) Species: 666 (Vibrio cholerae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GMRIDLHSHTTASDGRFTYQQLIDRAVSFEIDVLAITDHDTVAALADARA
YIAQQQYPLQLVNGIEISTVWQNKDIHIVGLNIDPNSEALGQLIARQQQR
RVERAELIAHRLQKATREGVLEEVQHIADGAPITRAHFAKWLVDNGYATN
MQQVFKKYLTRDNPGYVPPNWCSMSEAVSAIHAAGGQAVLAHPGRYDLTA
KWLKRLMTAFVEAGGDAMEVAQPQQSPQEKRTLGDYAMEYQLLASQGSDF
HYPSPWMELGRNLWLPAGVEPVWKDWGLSP
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 chain9etk Chain A Residue 312 [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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PDB9etk Macromolecular structure determination using X-rays, neutrons and electrons: recent developments in Phenix
Resolution1.48 Å
Binding residue
(original residue number in PDB)		D13 H38 H250
Binding residue
(residue number reindexed from 1)		D14 H39 H251
Annotation score4
External links