Ligand name: 2-azanyl-9-[(1~{R},6~{R},8~{R},9~{R},10~{S},15~{R},17~{R},18~{R})-8-[4-azanyl-5-(4-naphthalen-2-ylphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]-3,9,12,18-tetrakis(oxidanyl)-3,12-bis(oxidanylidene)-2,4,7,11,13,16-hexaoxa-3$l^{5},12$l^{5}-diphosphatricyclo[13.2.1.0^{6,10}]octadecan-17-yl]-3~{H}-purin-6-one
PDB ligand accession: KWF
DrugBank: n/a
PubChem: 165368568
ChEMBL: CHEMBL5189981
InChI Key: GFAYSQUXBCIDJM-NXVDNDCWSA-N
SMILES: c1ccc2cc(ccc2c1)c3ccc(cc3)c4cn(c5c4c(ncn5)N)C6C(C7C(O6)COP(=O)(OC8C(C(COP(=O)(O7)O)OC8n9cnc1c9NC(=NC1=O)N)O)O)O
Drug action: n/a

List of PDB structures and/or AlphaFold models with target protein Q86WV6

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
8A2I Download Experimental e8a2iA1
e8a2iB1
STING C-terminal domain
STING C-terminal domain
LigPlot