DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Chitinase
Ligand Name
methyl 4-[5,6-bis(chloranyl)-1H-indol-3-yl]-3-(5-chloranyl-1H-indol-3-yl)-1H-pyrrole-2-carboxylate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
HJXJUNZGSRTQEN-UHFFFAOYSA-N
SMILES
COC(=O)c1c(c(c[nH]1)c2c[nH]c3c2cc(c(c3)Cl)Cl)c4c[nH]c5c4cc(cc5)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 7VRG
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Color Legend
Unassigned regionsLigand / hetero atomse7vrgA1e7vrgA2e7vrgA3e7vrgB1e7vrgB2e7vrgB3
ECOD domains from experimental PDB structures interacting with ligand 7U8
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q4AE59n/a7U87vrge7vrgA1A:126-436,A:510-553
Q4AE59n/a7U87vrge7vrgA3A:437-509
Q4AE59n/a7U87vrge7vrgB1B:437-509
Q4AE59n/a7U87vrge7vrgB2B:126-436,B:510-553