Ligand · 3SU
3SU · (2Z)-3-(6-bromo-1H-indol-3-yl)-2-sulfanylprop-2-enoic acid
3SU, (2Z)-3-(6-bromo-1H-indol-3-yl)-2-sulfanylprop-2-enoic acid (C11 H8 Br N O2 S, 298.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it…
- Component
- 3SU
- Formula
- C11 H8 Br N O2 S
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
3SU in 4 structures; the first of them:
- 4WQ2 · Human calpain PEF(S) with (Z)-3-(6-bromondol-3-yl)-2-mercaptoacrylic acid bound · 3SU A301 · binds LEU124, VAL127, VAL128, HIS131, LEU134, PHE139, TRP168, ILE171 and 4 more
- 4WQ3 · Human calpain PEF(S) with (2Z,2Z')-2,2'-disulfanediylbis(3-(6-bromoindol-3-yl)acrylic… · 3SU A305 · binds PHE101, LEU104, PHE105, LEU108, ILE123, VAL127, ARG130, HIS131 and 2 more
- 4WQ2 · Human calpain PEF(S) with (Z)-3-(6-bromondol-3-yl)-2-mercaptoacrylic acid bound · 3SU A301 · binds LEU124, VAL127, VAL128, HIS131, LEU134, PHE139, TRP168, ILE171 and 4 more
- 4WQ3 · Human calpain PEF(S) with (2Z,2Z')-2,2'-DISULFANEDIYLBIS(3-(6- bromoindol-3-YL)ACRYLIC… · 3SU A305 · binds PHE101, LEU104, PHE105, LEU108, ILE123, VAL127, ARG130, HIS131 and 2 more
Residues it binds most
LEU 12, PHE 10, VAL 12, LYS 10, ILE 12, TRP 12, GLN 10, HIS 10, ARG 4 (residue and the binding sites it lines).
Found with
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