Structure of PDB 3qnd Chain C Binding Site BS01
Receptor Information
>3qnd Chain C (length=183) Species:
52275
(Human adenovirus D37) [
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TRTLWTTPDTSPNCTIAQDKDSKLTLVLTKCGSQILANVSLIVVAGKYHI
INNKTNPKIKSFTIKLLFNKNGVLLDNSNLGKAYWNFRSGNSNVSTAYEK
AIGFMPNLVAYPKPSNSKKYARDIVYGTIYLGGKPDQPAVIKTTFNQETG
CEYSITFNFSWSKTYENVEFETTSFTFSYIAQE
Ligand information
Ligand ID
ZN
InChI
InChI=1S/Zn/q+2
InChIKey
PTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Zn+2]
Formula
Zn
Name
ZINC ION
ChEMBL
CHEMBL1236970
DrugBank
DB14532
ZINC
PDB chain
3qnd Chain C Residue 9 [
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Receptor-Ligand Complex Structure
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PDB
3qnd
A potent trivalent sialic Acid inhibitor of adenovirus type 37 infection of human corneal cells.
Resolution
2.4 Å
Binding residue
(original residue number in PDB)
H231 E351
Binding residue
(residue number reindexed from 1)
H49 E169
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Biological Process
GO:0007155
cell adhesion
GO:0019058
viral life cycle
GO:0019062
virion attachment to host cell
Cellular Component
GO:0019028
viral capsid
View graph for
Biological Process
View graph for
Cellular Component
External links
PDB
RCSB:3qnd
,
PDBe:3qnd
,
PDBj:3qnd
PDBsum
3qnd
PubMed
21648036
UniProt
Q64823
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