Structure of PDB 6qdi Chain A Binding Site BS02

Receptor Information
>6qdi Chain A (length=294) Species: 288965 (Acetivibrio clariflavus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HMGLRGDYFDNIDLTNFKLTRVDKTIDFFWGVNSPAKEIRNDESYSVRWT
GKIRPLYSEEYTFYISRDNGVRLWIDNKLIIDKWDNLVGLEMGKIYLEAG
KLYDIKLEYFNNTGNGFVKLEWSSASTVRSIVPTECLYPAEPKHYGSSIP
GKGIGLFYEYFDEDNLTNPKEKGIDSVIDFNWGVGSPSKSINQDQKFSVR
WTGFIQVPYDGDYVFYVSYDDGASLWIDRQLLIDKWTASEINTAKTEAIS
LKAGQRVEVMLLYRNTGLAGSIRLEWEGPGIERSVVPQSCLYPR
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 chain6qdi Chain A Residue 404 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6qdi Distinctive ligand-binding specificities of tandem PA14 biomass-sensory elements from Clostridium thermocellum and Clostridium clariflavum.
Resolution1.13 Å
Binding residue
(original residue number in PDB)		D240 D241 N285 G287 A289
Binding residue
(residue number reindexed from 1)		D220 D221 N265 G267 A269
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links