Structure of PDB 5o65 Chain A Binding Site BS01
Receptor Information
>5o65 Chain A (length=276) Species:
452680
(Pseudomonas sp. UK4) [
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PAQSVSNLYNEASGFFGNGKFSFETGITYARYDDRIKADNWTLDLTGRYN
LDNRWQFDVNVPVVYRESTYQEESVSRDPTIGDVNFGIAYKFLDESATMP
DAVVSVRVKAPTGKEPFGIKLVYVPESLPTGNGVWSITPGLSMVKTFDPA
VLFGSVSYTHNLEDSFDDISSDVNQKVGGKVRLGDSFQFGVGVAFALNER
MSMSFSVSDLIQRKSKLKPDGGGWQSIVSSDANAGYFNVGMTIAASENLT
IVPNLAIGMTDDAPDFTFSLKFPYYF
Ligand information
Ligand ID
C8E
InChI
InChI=1S/C16H34O5/c1-2-3-4-5-6-7-9-18-11-13-20-15-16-21-14-12-19-10-8-17/h17H,2-16H2,1H3
InChIKey
FEOZZFHAVXYAMB-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 10.04
O(CCCCCCCC)CCOCCOCCOCCO
CACTVS 3.341
OpenEye OEToolkits 1.5.0
CCCCCCCCOCCOCCOCCOCCO
Formula
C16 H34 O5
Name
(HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE
ChEMBL
DrugBank
DB04233
ZINC
ZINC000014881140
PDB chain
5o65 Chain A Residue 503 [
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Receptor-Ligand Complex Structure
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PDB
5o65
A new class of hybrid secretion system is employed in Pseudomonas amyloid biogenesis.
Resolution
2.5 Å
Binding residue
(original residue number in PDB)
F166 V168
Binding residue
(residue number reindexed from 1)
F57 V59
Annotation score
1
External links
PDB
RCSB:5o65
,
PDBe:5o65
,
PDBj:5o65
PDBsum
5o65
PubMed
28811582
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