Structure of PDB 9bju Chain K Binding Site BS01
Receptor Information
>9bju Chain K (length=87) Species:
9606
(Homo sapiens) [
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MYVKLISSDGHEFIVKREHALTSGTIKAMLSTNEVNFREIPSHVLSKVCM
YFTYKVRYTNSSTEIPEFPIAPEIALELLMAANFLDC
Ligand information
Ligand ID
TFA
InChI
InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)
InChIKey
DTQVDTLACAAQTR-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 12.01
FC(F)(F)C(=O)O
CACTVS 3.370
OC(=O)C(F)(F)F
OpenEye OEToolkits 1.7.0
C(=O)(C(F)(F)F)O
Formula
C2 H F3 O2
Name
trifluoroacetic acid
ChEMBL
CHEMBL506259
DrugBank
ZINC
ZINC000003860798
PDB chain
9bju Chain K Residue 202 [
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Receptor-Ligand Complex Structure
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PDB
9bju
Potency-enhanced peptidomimetic VHL ligands with improved oral bioavailability
Resolution
2.47 Å
Binding residue
(original residue number in PDB)
V19 K20
Binding residue
(residue number reindexed from 1)
V3 K4
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:9bju
,
PDBe:9bju
,
PDBj:9bju
PDBsum
9bju
PubMed
UniProt
Q15369
|ELOC_HUMAN Elongin-C (Gene Name=ELOC)
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