Structure of PDB 4glu Chain D Binding Site BS01
Receptor Information
>4glu Chain D (length=95) [
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EVVKFMDVYQRSYCHPIETLVDIFQEYPDEIEYIFKPSCVPLMRCGGCCN
DEGLECVPTEESNITMQIMRIKPHQGQHIGEMSFLQHNKCECRPK
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
4glu Chain D Residue 204 [
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Receptor-Ligand Complex Structure
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PDB
4glu
Chemical synthesis and X-ray structure of a heterochiral {D-protein antagonist plus vascular endothelial growth factor} protein complex by racemic crystallography.
Resolution
1.9 Å
Binding residue
(original residue number in PDB)
G51 G52
Binding residue
(residue number reindexed from 1)
G46 G47
Annotation score
1
External links
PDB
RCSB:4glu
,
PDBe:4glu
,
PDBj:4glu
PDBsum
4glu
PubMed
22927390
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