Attributes
UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
(3S,8S,9S,12S)-3,12-BIS(1,1-DIMETHYLETHYL)-8-HYDROXY-4,11-DIOXO-9-(PHENYLMETHYL)-6-[[4-(2-PYRIDINYL)PHENYL]METHYL]-2,5, 6,10,13-PENTAAZATETRADECANEDIOIC ACID DIMETHYL ESTER
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
AXRYRYVKAWYZBR-GASGPIRDSA-N
SMILES
CC(C)(C)C(C(=O)NC(Cc1ccccc1)C(CN(Cc2ccc(cc2)c3ccccn3)NC(=O)C(C(C)(C)C)NC(=O)OC)O)NC(=O)OC
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3EKW
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Color Legend
Unassigned regionsLigand / hetero atomse3ekwA1e3ekwB1
ECOD domains from experimental PDB structures interacting with ligand DB01072
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P03369 | DB01072 | DR7 | 3ekw | e3ekwA1 | A:1-99 |
| P03369 | DB01072 | DR7 | 3ekw | e3ekwB1 | B:1-99 |
| P03369 | DB01072 | DR7 | 3eky | e3ekyA1 | A:1-99 |
| P03369 | DB01072 | DR7 | 3eky | e3ekyB1 | B:1-99 |
| P03369 | DB01072 | DR7 | 3el1 | e3el1A1 | A:1-99 |
| P03369 | DB01072 | DR7 | 3el1 | e3el1B1 | B:1-99 |
| P03369 | DB01072 | DR7 | 3el9 | e3el9A1 | A:1-99 |
| P03369 | DB01072 | DR7 | 3el9 | e3el9B1 | B:1-99 |
| P03369 | DB01072 | DR7 | 3em4 | e3em4A1 | A:1-99 |
| P03369 | DB01072 | DR7 | 3em4 | e3em4B1 | B:1-99 |
| P03369 | DB01072 | DR7 | 3em4 | e3em4U1 | U:1-99 |
| P03369 | DB01072 | DR7 | 3em4 | e3em4V1 | V:1-99 |
| P03369 | DB01072 | DR7 | 3oxx | e3oxxA1 | A:1-99 |
| P03369 | DB01072 | DR7 | 3oxx | e3oxxB1 | B:1-99 |
| P03369 | DB01072 | DR7 | 3oxx | e3oxxC1 | C:1-99 |
| P03369 | DB01072 | DR7 | 3oxx | e3oxxD1 | D:1-99 |