PDB ligand accession: IBG
DrugBank: DB03597
PubChem:
ChEMBL: n/a
InChI Key: QFYJAEOZTBVJQM-STQMWFEESA-N
SMILES: c1ccc(c(c1)CSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)I
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 |
---|---|---|---|---|---|
1GUL | Download | Experimental | e1gulA2 e1gulA1 e1gulB1 e1gulB2 e1gulA1 e1gulB1 e1gulC2 e1gulD1 e1gulC1 e1gulD2 e1gulD1 e1gulC1 e1gulE2 e1gulE1 e1gulF1 e1gulF2 e1gulE1 e1gulF1 e1gulG2 e1gulH1 e1gulG1 e1gulG2 e1gulH2 e1gulH1 e1gulG1 | Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins Thioredoxin-like Thioredoxin-like Repetitive alpha hairpins Repetitive alpha hairpins | LigPlot |