Structure of PDB 8ehz Chain B Binding Site BS02
Receptor Information
>8ehz Chain B (length=127) Species:
9606
(Homo sapiens) [
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SPSAQELKEQGNRLFVGRKYPEAAACYGRAITRNPLVAVYYTNRALCYLK
MQQHEQALADCRRALELDGQSVKAHFFLGQCQLEMESYDEAIANLQRAYS
LAKEQRLNFGDDIPSALRIAKKKRWNS
Ligand information
Ligand ID
WHL
InChI
InChI=1S/C10H12N2O2/c1-7(13)11-9-3-5-10(6-4-9)12-8(2)14/h3-6H,1-2H3,(H,11,13)(H,12,14)
InChIKey
KVEDKKLZCJBVNP-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 2.0.7
CC(=O)Nc1ccc(cc1)NC(=O)C
CACTVS 3.385
CC(=O)Nc1ccc(NC(C)=O)cc1
ACDLabs 12.01
O=C(C)Nc1ccc(cc1)NC(C)=O
Formula
C10 H12 N2 O2
Name
N,N'-(1,4-phenylene)diacetamide
ChEMBL
DrugBank
ZINC
ZINC000000075340
PDB chain
8ehz Chain D Residue 101 [
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Receptor-Ligand Complex Structure
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PDB
8ehz
Recognition and reprogramming of E3 ubiquitin ligase surfaces by alpha-helical peptides
Resolution
2.06 Å
Binding residue
(original residue number in PDB)
F131 D134
Binding residue
(residue number reindexed from 1)
F109 D112
Annotation score
1
Enzymatic activity
Enzyme Commision number
2.3.2.27
: RING-type E3 ubiquitin transferase.
External links
PDB
RCSB:8ehz
,
PDBe:8ehz
,
PDBj:8ehz
PDBsum
8ehz
PubMed
37914719
UniProt
Q9UNE7
|CHIP_HUMAN E3 ubiquitin-protein ligase CHIP (Gene Name=STUB1)
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