Structure of PDB 8u0r Chain D Binding Site BS01
Receptor Information
>8u0r Chain D (length=74) Species:
696871
(Vaccinia virus Western Reserve) [
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KNFICVDDRLFSYNFTTSGIKAKVAVDNKNVPIPCSKINEVNNNKDVDTL
YCDKDRDDIPGFARSCYRAYSDLF
Ligand information
Ligand ID
PDO
InChI
InChI=1S/C3H8O2/c4-2-1-3-5/h4-5H,1-3H2
InChIKey
YPFDHNVEDLHUCE-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.7.0
C(CO)CO
ACDLabs 11.02
CACTVS 3.352
OCCCO
Formula
C3 H8 O2
Name
1,3-PROPANDIOL
ChEMBL
CHEMBL379652
DrugBank
DB02774
ZINC
ZINC000001529437
PDB chain
8u0r Chain D Residue 204 [
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Receptor-Ligand Complex Structure
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PDB
8u0r
The crystal structure of protein A21, a component of the conserved poxvirus entry-fusion complex
Resolution
2.3 Å
Binding residue
(original residue number in PDB)
G101 A103
Binding residue
(residue number reindexed from 1)
G61 A63
Annotation score
1
External links
PDB
RCSB:8u0r
,
PDBe:8u0r
,
PDBj:8u0r
PDBsum
8u0r
PubMed
UniProt
P68711
|A21_VACCA Virion membrane protein A21 (Gene Name=MVA131L)
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