DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
(6S)-2-(3-chloro-4-fluorobenzyl)-8-ethyl-10-hydroxy-N,6-dimethyl-1,9-dioxo-1,2,6,7,8,9-hexahydropyrazino[1',2':1,5]pyrrolo[2,3-d]pyridazine-4-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JSRREMIKIHJGAA-JTQLQIEISA-N
SMILES
CCN1CC(n2c3c(c(c2C1=O)O)C(=O)N(N=C3C(=O)NC)Cc4ccc(c(c4)Cl)F)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 7JN3
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Color Legend
Unassigned regionsLigand / hetero atomse7jn3A1e7jn3A2e7jn3A3e7jn3B1e7jn3B2e7jn3C1e7jn3C2e7jn3D1e7jn3D2e7jn3E1e7jn3E2e7jn3E3e7jn3F1e7jn3F2e7jn3G1e7jn3G2e7jn3H1e7jn3H2
ECOD domains from experimental PDB structures interacting with ligand ZZX
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P03354n/aZZX7jn3e7jn3A3A:45-215
P03354n/aZZX7jn3e7jn3E3E:45-215
P03354n/aZZX7ku7e7ku7A1A:45-215
P03354n/aZZX7ku7e7ku7E3E:45-215
P03354n/aZZX7kuie7kuiA2A:45-215
P03354n/aZZX7kuie7kuiE3E:45-215