DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Galactokinase
Ligand Name
(4R)-2-[(1,3-benzoxazol-2-yl)amino]-4-(4-chloro-1H-pyrazol-5-yl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ORBGGGFENULXFO-MRXNPFEDSA-N
SMILES
c1ccc2c(c1)nc(o2)NC3=NC(C4=C(N3)CCCC4=O)c5c(cn[nH]5)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 7S49
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse7s49A1e7s49A2e7s49B1e7s49B2
ECOD domains from experimental PDB structures interacting with ligand 4QI
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P51570n/a4QI7s49e7s49A1A:2-216
P51570n/a4QI7s49e7s49A2A:217-392
P51570n/a4QI7s49e7s49B1B:2-216
P51570n/a4QI7s49e7s49B2B:217-392