Structure of PDB 7f6r Chain A Binding Site BS03

Receptor Information
>7f6r Chain A (length=337) Species: 300852 (Thermus thermophilus HB8) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QSRPASDPQVVEAARKEGRLIIYSSTDQSSAQALLDDFRKLYPFIQIEYN
DLGTQAIYDRFVSETAAGASSADLLWSSAMELQVKLASEGYALPYDSPEA
KNWPANARLGNLAYSTTLEPAVVVYNKRFLKPEEVPTTREGLARLLQEPR
MRGRVATWDPERAAVGFTILKADYDRFPAFQELARAFGKAQAALYSSTGA
AFEKVISGEHYLAYGFFGSYALLRQRTVKDLGIAYLTDGTVAIQRVAFIN
KRAAHPNAAKLFLDYLLSLRGQNLMAYTALIFARRETVVGEATPQALYKA
VGGKDKVYAIPVSTEILKNLDPAERMRFLTFWRQAVR
Ligand information
Ligand IDCO3
InChIInChI=1S/CH2O3/c2-1(3)4/h(H2,2,3,4)/p-2
InChIKeyBVKZGUZCCUSVTD-UHFFFAOYSA-L
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(=O)([O-])[O-]
ACDLabs 10.04
CACTVS 3.341		[O-]C([O-])=O
FormulaC O3
NameCARBONATE ION
ChEMBL
DrugBankDB14531
ZINC
PDB chain7f6r Chain A Residue 410 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7f6r Structural and thermodynamic insights into a novel Mg 2+ -citrate-binding protein from the ABC transporter superfamily.
Resolution2.09 Å
Binding residue
(original residue number in PDB)		G54 T55
Binding residue
(residue number reindexed from 1)		G53 T54
Annotation score3
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding
Cellular Component
GO:0030288 outer membrane-bounded periplasmic space

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Molecular Function
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Cellular Component
External links
PDB RCSB:7f6r, PDBe:7f6r, PDBj:7f6r
PDBsum7f6r
PubMed34866608
UniProtQ53VZ2

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