Structure of PDB 8st7 Chain D Binding Site BS01
Receptor Information
>8st7 Chain D (length=75) Species:
9606
(Homo sapiens) [
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MQIFVKTLTGKTITLEVEPSDTIENVKAKIQDKEGIPPDQQRLIFAGKQL
EDGRTLSDYNIQKESTLHLVLRLRG
Ligand information
Ligand ID
AYE
InChI
InChI=1S/C3H7N/c1-2-3-4/h2H,1,3-4H2
InChIKey
VVJKKWFAADXIJK-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
NCC=C
OpenEye OEToolkits 1.5.0
C=CCN
ACDLabs 10.04
C=C\CN
Formula
C3 H7 N
Name
prop-2-en-1-amine;
ALLYLAMINE
ChEMBL
CHEMBL57286
DrugBank
ZINC
ZINC000017654097
PDB chain
8st7 Chain D Residue 901 [
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Receptor-Ligand Complex Structure
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PDB
8st7
Bacterial mimicry of eukaryotic HECT ubiquitin ligation.
Resolution
1.44 Å
Binding residue
(original residue number in PDB)
R74 G75
Binding residue
(residue number reindexed from 1)
R74 G75
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:8st7
,
PDBe:8st7
,
PDBj:8st7
PDBsum
8st7
PubMed
38091999
UniProt
P0CG48
|UBC_HUMAN Polyubiquitin-C (Gene Name=UBC)
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