Ligand · 2J8
2J8 · (4S,11S,18S)-4,11,18-tri(propan-2-yl)-6,13,20-triselena-3,10,17,22,23,24-hexaazatetracyclo[17.2.1.1~5,8~.1~12,15~]tetracosa-1(21),5(24),7,12(23),14,19(22)-hexaene-2,9,16-trione
2J8, (4S,11S,18S)-4,11,18-tri(propan-2-yl)-6,13,20-triselena-3,10,17,22,23,24-hexaazatetracyclo[17.2.1.1~5,8~.1~12,15~]tetracosa-1(21),5(24),7,12(23),14,19(22)-hexaene-2,9,16-trione (C24 H30 N6 O3 Se3, 687.4 g/mol), in the MolNFT…
- Component
- 2J8
- Formula
- C24 H30 N6 O3 Se3
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
2J8 in 4 structures; the first of them:
- 3G61 · Structure of P-glycoprotein Reveals a Molecular Basis for Poly-Specific Drug Binding · 2J8 A6001 · binds LEU300, TYR303, PHE339, GLN721, PHE724, LEU758, PHE974, VAL978 and 5 more
- 4M2T · Corrected Structure of Mouse P-glycoprotein bound to QZ59-SSS · 2J8 A6001 · binds MET295, ALA298, PHE299, ILE302, TYR303, TYR306, LEU335, ILE336 and 8 more
- 3G61 · Structure of P-glycoprotein reveals a molecular basis for poly- specific drug binding · 2J8 A6001 · binds LEU300, TYR303, PHE339, GLN721, PHE724, LEU758, PHE974, VAL978 and 5 more
- 4M2T · Corrected structure of mouse P-glycoprotein bound to QZ59-sss · 2J8 A6001 · binds MET295, ALA298, PHE299, ILE302, TYR303, TYR306, LEU335, ILE336 and 8 more
Residues it binds most
PHE 16, LEU 16, MET 16, TYR 16, GLN 8, ILE 10, ALA 10, VAL 12, SER 10, GLY 4 (residue and the binding sites it lines).
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