Structure of PDB 1i8n Chain B Binding Site BS01
Receptor Information
>1i8n Chain B (length=89) Species:
6410
(Haementeria officinalis) [
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ETITAGNEDCWSKRPGWKLPDNLLTKTEFTSVDECRKMCEESAVEPSCYI
LQINTETNECYRNNEGDVTWSSLQYDQPNVVQWHLHACS
Ligand information
Ligand ID
ROP
InChI
InChI=1S/C3H7NO/c1-2-3(4)5/h2H2,1H3,(H2,4,5)
InChIKey
QLNJFJADRCOGBJ-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 10.04
O=C(N)CC
OpenEye OEToolkits 1.5.0
CCC(=O)N
CACTVS 3.341
CCC(N)=O
Formula
C3 H7 N O
Name
PROPIONAMIDE
ChEMBL
CHEMBL1235716
DrugBank
DB04161
ZINC
ZINC000001670847
PDB chain
1i8n Chain B Residue 701 [
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Receptor-Ligand Complex Structure
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PDB
1i8n
The structure of leech anti-platelet protein, an inhibitor of haemostasis.
Resolution
2.2 Å
Binding residue
(original residue number in PDB)
D69 R72
Binding residue
(residue number reindexed from 1)
D33 R36
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0090729
toxin activity
Biological Process
GO:0035821
modulation of process of another organism
Cellular Component
GO:0005576
extracellular region
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Molecular Function
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Cellular Component
External links
PDB
RCSB:1i8n
,
PDBe:1i8n
,
PDBj:1i8n
PDBsum
1i8n
PubMed
11468390
UniProt
Q01747
|LAPP_HAEOF Leech anti-platelet protein
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