Ligand · 0TE

0TE · chloro{methyl hydrogenato(3-)-kappa~2~N,S [pyridin-2-yl(pyridin-2(1H)-ylidene-kappaN)methyl]carbonodithiohydrazonate}copper

0TE, chloro{methyl hydrogenato(3-)-kappa~2~N,S [pyridin-2-yl(pyridin-2(1H)-ylidene-kappaN)methyl]carbonodithiohydrazonate}copper (C13 H11 Cl Cu N4 S2, 386.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component: 0TE
Formula: C13 H11 Cl Cu N4 S2
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

0TE in 2 structures; the first of them:

4FEA · Crystal structure of CASPASE-7 in Complex with allosteric inhibitor · 0TE A701 · binds TYR223, CYS290, VAL292, GLU216, PHE221, VAL292, MET294
4FEA · Crystal structure of caspase-7 in complex with allosteric inhibitor · 0TE A701 · binds TYR223, CYS290, VAL292, GLU216, PHE221, VAL292, MET294

Residues it binds most

VAL 4, CYS 4, GLU 4, MET 4, PHE 4, TYR 4, ILE 2 (residue and the binding sites it lines).

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