Structure of PDB 4nuq Chain A Binding Site BS02

Receptor Information
>4nuq Chain A (length=215) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DFVIPPINLPENSRGPFPQELVRIRSDRDKNLSLRYSVTGPGADQPPTGI
FIINPISGQLSVTKPLDRELIARFHLRAHAVDINGNQVENPIDIVINVID
MNDNRPEFLHQVWNGSVPEGSKPGTYVMTVTAIDADDPNALNGMLRYRIL
SQAPSTPSPNMFTINNETGDIITVAAGLDREKVQQYTLIIQATDMEGNPT
YGLSNTATAVITVTD
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 chain4nuq Chain A Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4nuq Structural and energetic determinants of adhesive binding specificity in type I cadherins.
Resolution2.116 Å
Binding residue
(original residue number in PDB)		E11 E69 D100 M101 D103 D136
Binding residue
(residue number reindexed from 1)		E11 E69 D100 M101 D103 D136
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005509 calcium ion binding
Biological Process
GO:0007155 cell adhesion
GO:0007156 homophilic cell adhesion via plasma membrane adhesion molecules
GO:0098609 cell-cell adhesion
Cellular Component
GO:0005886 plasma membrane
GO:0016020 membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:4nuq, PDBe:4nuq, PDBj:4nuq
PDBsum4nuq
PubMed25253890
UniProtP15116|CADH2_MOUSE Cadherin-2 (Gene Name=Cdh2)

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