Structure of PDB 7w78 Chain A Binding Site BS01

Receptor Information
>7w78 Chain A (length=218) Species: 257309 (Corynebacterium diphtheriae NCTC 13129) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AAPVLSITNASVVYPDGISTVTALDSANVEIFPGELVAIVGESGSGKSTL
LSIAGFLQEPTSGTVTLHGAEGLDATSTRREHIGFVFQQPNLLGSLTARE
QLLITDHLRGIKPRKDRADELLARVGLKGLGGRRVAQLSGGQRQRVNIAR
ALMGNPQLLLADEPTSALDARLSKEIVELLRDVTKEFALATLMVTHDRSQ
LAYADRFVEMADGKALQT
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 chain7w78 Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7w78 Structural basis for heme detoxification by an ATP-binding cassette-type efflux pump in gram-positive pathogenic bacteria.
Resolution2.884 Å
Binding residue
(original residue number in PDB)		S50 Q90
Binding residue
(residue number reindexed from 1)		S48 Q88
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005524 ATP binding
GO:0016887 ATP hydrolysis activity
GO:0022857 transmembrane transporter activity
GO:0046872 metal ion binding
Biological Process
GO:0055085 transmembrane transport
Cellular Component
GO:0005886 plasma membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7w78, PDBe:7w78, PDBj:7w78
PDBsum7w78
PubMed35767641
UniProtQ6NEF2

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