Structure of PDB 3usu Chain E Binding Site BS01

Receptor Information
>3usu Chain E (length=250) Species: 56060 (Butea monosperma) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TTNTDSFTFSKFKPNQPNLKKQGDATVTSSGTLQLTKVDKNGVPDPKSLG
RALYASPINIWDSKTGVVASFATSFRFTIYAPNIATIADGLAFFLAPVSS
PPKAGAGFLGLFDSAVFNSSYQTVAVEFDTYENTVFLDPPDTHIGIDVNS
IKSIKTVKWDLANGEAAKVLITYDSSAKLLVAALVYPSSKTSFILSDVVD
LKSVLPEWVSIGFSAATGASSGYIETHDVFSWSFASKLSFLDLASFLVAN
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 chain3usu Chain E Residue 262 [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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PDB3usu Crystal structure of Butea monosperma seed lectin
Resolution2.46 Å
Binding residue
(original residue number in PDB)		D129 Y131 N133 D138
Binding residue
(residue number reindexed from 1)		D129 Y131 N133 D138
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0030246 carbohydrate binding
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:3usu, PDBe:3usu, PDBj:3usu
PDBsum3usu
PubMed
UniProtH2L2M6

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