Structure of PDB 1enq Chain D Binding Site BS01

Receptor Information
>1enq Chain D (length=224) Species: 3823 (Canavalia ensiformis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ADTIVAVELDTYPNPSYPHIGIDIKSVRSKKTAKWNMQNGKVGTAHIIYN
SVDKRLSAVVSYPNADSATVSYDVDLDNVLPEWVRVGLSASTGLYKETNT
ILSWSFTSKLKSNSTHETNALHFMFNQFSKDQKDLILQGDATTGTDGNLE
LTRVSSVGRALFYAPVHIWESSAVVASFEATFTFLIKSPDSHPADGIAFF
ISNIDSSIPSGSTGRLLGLFPDAN
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain1enq Chain D Residue 238 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1enq Sequential structural changes upon zinc and calcium binding to metal-free concanavalin A.
Resolution2.5 Å
Binding residue
(original residue number in PDB)
E8 D10 H24
Binding residue
(residue number reindexed from 1)
E8 D10 H19
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0030246 carbohydrate binding

View graph for
Molecular Function
External links
PDB RCSB:1enq, PDBe:1enq, PDBj:1enq
PDBsum1enq
PubMed8663112
UniProtP02866|CONA_CANEN Concanavalin-A

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