Structure of PDB 3c9h Chain A Binding Site BS01

Receptor Information
>3c9h Chain A (length=334) Species: 176299 (Agrobacterium fabrum str. C58) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PALAQVAVFPALSGQTLVVYSSLDEPLATPMIEGFQKANPDIAVHYEDML
TGEIYDRIVKETDAGKKTADFAFSSAMDLQVKLSNDGYAQRSDLAMSARW
PAWANWRNTAYALTFEPAVFVYHKPSFTTEKPPATRAEFVDYLERHAKEV
HGRIATYDIERGVGFLFMSRDQEQFGDIWSVIKAMGAAGVKVYSTSSAIL
ERVSDGRFVLGYNILGSYAADWASRHPDVGIVLPKDYTVVMSRIGLVPEA
AANPELGRRYLEFFMSKEGQTIMARQLQIPAVSPEVAGENTANTMQAIHG
AQLRPVPVSPGLMVYLDQVKRSRLIERWNEALRS
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 chain3c9h Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3c9h The crystal structure of the substrate binding protein of the ABC transporter from Agrobacterium tumefaciens.
Resolution1.9 Å
Binding residue
(original residue number in PDB)		S41 D43
Binding residue
(residue number reindexed from 1)		S22 D24
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links