Ligand name: cucurbit[7]uril
PDB ligand accession: QQ7
DrugBank: n/a
PubChem: n/a
ChEMBL: CHEMBL3770339
InChI Key: ZDOBFUIMGBWEAB-XGFHMVPTSA-N
SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)CN5C%13C%14N(C5=O)CN5C%15C(N1C5=O)N1CN3C(=O)N4CN6C(=O)N7CN9C(=O)N2CN8C(=O)N%10CN%11C(=O)N%12CN%13C(=O)N%14CN%15C1=O
Drug action: n/a

ClassyFire chemical classification:

List of PDB structures and/or AlphaFold models with target protein A0A0S4TLR1

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
8CF7 Download Experimental e8cf7A1
e8cf7B1
e8cf7C1
e8cf7D1
e8cf7E1
e8cf7F1
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
LigPlot
6ZUK Download Experimental e6zukA1
e6zukB1
e6zukC1
e6zukD1
e6zukE1
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
LigPlot
7P2H Download Experimental e7p2hA1
e7p2hB1
beta-propeller-like
beta-propeller-like
LigPlot
6F7W Download Experimental e6f7wA1
e6f7wB1
e6f7wC1
beta-propeller-like
beta-propeller-like
beta-propeller-like
LigPlot
6F7X Download Experimental e6f7xA1
e6f7xB1
beta-propeller-like
beta-propeller-like
LigPlot
7P2I Download Experimental e7p2iA1
e7p2iC1
beta-propeller-like
beta-propeller-like
LigPlot
7P2J Download Experimental e7p2jA1
e7p2jB1
beta-propeller-like
beta-propeller-like
LigPlot
6ZUL Download Experimental e6zulA1
e6zulB1
e6zulC1
e6zulD1
e6zulE1
e6zulF1
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
LigPlot
8CF6 Download Experimental e8cf6A1
e8cf6B1
beta-propeller-like
beta-propeller-like
LigPlot
6SU0 Download Experimental e6su0A1
e6su0I1
e6su0B1
e6su0J1
e6su0C1
e6su0K1
e6su0B1
e6su0I1
e6su0C1
e6su0J1
e6su0A1
e6su0K1
e6su0F1
e6su0M1
e6su0E1
e6su0N1
e6su0F1
e6su0O1
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
beta-propeller-like
LigPlot
6ZUM Download Experimental e6zumA1
beta-propeller-like
LigPlot