Attributes
UniProt ID
Protein Name
clade A/E 93TH057 HIV-1 gp120 core
Ligand Name
N-(4-chloro-3-fluorophenyl)-N'-{[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl}ethanediamide
DrugBank ID
n/a
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
WJMIBQNZONFNCE-SNVBAGLBSA-N
SMILES
c1cc(c(cc1NC(=O)C(=O)NCC2CCN(C2)C3CC3)F)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 4DVX
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Color Legend
Unassigned regionsLigand / hetero atomse4dvxA1e4dvxA2e4dvxB1e4dvxB2
ECOD domains from experimental PDB structures interacting with ligand 0M5
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| A0A0M3KKW9 | n/a | 0M5 | 4dvx | e4dvxA1 | A:44-255,A:474-492 |
| A0A0M3KKW9 | n/a | 0M5 | 4dvx | e4dvxA2 | A:256-473 |
| A0A0M3KKW9 | n/a | 0M5 | 4dvx | e4dvxB1 | B:256-473 |
| A0A0M3KKW9 | n/a | 0M5 | 4dvx | e4dvxB2 | B:44-255,B:474-492 |