Structure of PDB 9ftg Chain A Binding Site BS01

Receptor Information
>9ftg Chain A (length=559) Species: 1385624 (Desulfofustis sp. PB-SRB1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VQHFTGYIEDGRGIFYSLPDSMQNTGGNLDPLVGIMAEEIDPAVSLGQVL
EKALASENDLISELTAVADRIFLGWDDDGGKGYSEFTIPRDGTYHIFAGS
TITNQRLDKFQPTYTTGSFQLILEVFASLASLEIKPEAHVQELEIRLDKD
TRYLTQHTRNLQPGDTFHALVEPIGEAPLPRLRLTDSGGKPLAFGLISVE
LNYTCDQDICELVVHVDGTDDSGEAVYRLLVGINAPNLRVGSSVFLESDL
VTVGLAVDQIVGVDQRSENFSVVGTLKLSWHDPKLGFSPDQCGCTVKSFE
DASIRAVAGEINLPLPSFSFYNQQGNRWSQNQVIFVTPDGRASYFERFTV
TLQAPDFDFLAYPFDRQKFSIKVDLAVPTNMFIFNEIERFQQVVGDQLGE
EEWVVTSYSQEITEVPFERGSTNSRFTTTLLVKRNLEYYILRIFVPLFLI
ISVSWVIFFLKDYGRQLEVASGNLLVFVAFNFTISGDLPRLGYLTVLDRF
MIVSFCLTAIVVLISVCQKRLGAVGKQAVAAQIDTWVLVIYPLVYSLYII
WVYLRFFTD
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 chain9ftg Chain A Residue 701 [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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PDB9ftg Structural characterization of pH-modulated closed and open states in a pentameric ligand-gated ion channel
Resolution3.1 Å
Binding residue
(original residue number in PDB)		E347 P434 F436
Binding residue
(residue number reindexed from 1)		E268 P355 F357
Annotation score4
External links