Ligand · 865
865 · 7-[2-(1H-imidazol-1-yl)-4-methylpyridin-3-yl]-3-[3-(naphthalen-1-yloxy)propyl]-1-[2-oxo-2-(piperazin-1-yl)ethyl]-1H-indole-2-carboxylic acid
865, 7-[2-(1H-imidazol-1-yl)-4-methylpyridin-3-yl]-3-[3-(naphthalen-1-yloxy)propyl]-1-[2-oxo-2-(piperazin-1-yl)ethyl]-1H-indole-2-carboxylic acid (C37 H36 N6 O4, 628.7 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2…
- Component
- 865
- Formula
- C37 H36 N6 O4
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
865 in 4 structures; the first of them:
- 4WMR · STRUCTURE OF MCL1 BOUND TO BRD inhibitor ligand 1 AT 1.7A · 865 A404 · binds HIS224, ALA227, PHE228, MET231, LEU235, LEU246, VAL249, MET250 and 10 more
- 4WMT · STRUCTURE OF MBP-MCL1 BOUND TO ligand 1 AT 2.35A · 865 A402 · binds HIS224, ALA227, PHE228, MET231, LEU235, LEU246, VAL249, MET250 and 10 more
- 4WMR · Structure of MCL1 bound to brd inhibitor ligand 1 at 1.7A · 865 A404 · binds HIS224, ALA227, PHE228, MET231, LEU235, LEU246, VAL249, MET250 and 10 more
- 4WMT · Structure of mbp-MCL1 bound to ligand 1 at 2.35A · 865 A402 · binds HIS224, ALA227, PHE228, MET231, LEU235, LEU246, VAL249, MET250 and 10 more
Residues it binds most
LEU 4, PHE 4, VAL 4, MET 4, ALA 4, ARG 4, GLY 4, HIS 4, ILE 4, THR 4 (residue and the binding sites it lines).
Found with
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