Structure of PDB 1dgr Chain N Binding Site BS01

Receptor Information
>1dgr Chain N (length=76) Species: 3823 (Canavalia ensiformis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DKPFNLRSRDPIYSNNYGKLYEITPEKNSQLRDLDILLNCLQMNEGALFV
PHYNSRATVILVANEGRAEVELVGLE
Ligand information
Ligand IDPO4
InChIInChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-3
InChIKeyNBIIXXVUZAFLBC-UHFFFAOYSA-K
SMILES
SoftwareSMILES
CACTVS 3.341[O-][P]([O-])([O-])=O
ACDLabs 10.04[O-]P([O-])([O-])=O
OpenEye OEToolkits 1.5.0[O-]P(=O)([O-])[O-]
FormulaO4 P
NamePHOSPHATE ION
ChEMBL
DrugBankDB14523
ZINC
PDB chain1dgr Chain N Residue 3500 [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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PDB1dgr X-ray diffraction and atomic force microscopy analysis of twinned crystals: rhombohedral canavalin.
Resolution2.6 Å
Binding residue
(original residue number in PDB)		H297 N299
Binding residue
(residue number reindexed from 1)		H52 N54
Annotation score3
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:1dgr, PDBe:1dgr, PDBj:1dgr
PDBsum1dgr
PubMed11375502
UniProtP50477|CANA_CANEN Canavalin

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