Structure of PDB 4l8q Chain A Binding Site BS02

Receptor Information
>4l8q Chain A (length=233) Species: 232301 (Canavalia grandiflora) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ADTIVAVELDTYPNTDIGDPNYPHIGIDIKSIRSKKIAKWNMQDGKVATA
HIIYNSVGKRLSAVVSYPNADSATVSYDVDLDNVLPEWVRVGLSATTGLY
KETNTILSWSFTSKLKAETNALHFTFNQFTKDQKDLILQGDATTDSDGNL
QLTRVSSDGTPQGNSVGRALFYAPVHIWESSAVVASFDATFTFLIKSPDS
DPADGITFFISNMDSTIPSGSGGRLLGLFPDAN
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain4l8q Chain A Residue 302 [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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PDB4l8q Vasorelaxant activity of Canavalia grandiflora seed lectin: A structural analysis.
Resolution2.3 Å
Binding residue
(original residue number in PDB)
E8 D10 D19 H24
Binding residue
(residue number reindexed from 1)
E8 D10 D19 H24
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005537 D-mannose binding
GO:0030246 carbohydrate binding
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:4l8q, PDBe:4l8q, PDBj:4l8q
PDBsum4l8q
PubMed24361256
UniProtA0A067XG71|LECA_CANGR Lectin ConGF

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