PDB ligand accession: T44
DrugBank: DB00451
PubChem: 5819;25201348;
ChEMBL:
InChI Key: XUIIKFGFIJCVMT-LBPRGKRZSA-N
SMILES: c1c(cc(c(c1I)Oc2cc(c(c(c2)I)O)I)I)CC(C(=O)O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1ICT | Download | Experimental | e1ictC1 e1ictA1 e1ictA1 e1ictB1 e1ictD1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |
5CR1 | Download | Experimental | e5cr1A1 | Immunoglobulin-like beta-sandwich | LigPlot |
1F86 | Download | Experimental | e1f86A1 e1f86B1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |
1ETA | Download | Experimental | e1eta11 e1eta21 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |
1ETB | Download | Experimental | e1etb11 e1etb21 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |
3OZK | Download | Experimental | e3ozkA1 e3ozkA1 e3ozkB1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |
2ROX | Download | Experimental | e2roxA1 e2roxB1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |