GL1X · GenesisL1 explorer

Ligand · ZLS

ZLS · (1S)-N-[(1S)-7,7-dihydroxy-1-{4-[(1R,4S)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-6-yl]-1H-imidazol-2-yl}nonyl]-6-methyl-6-azaspiro[2.5]octane-1-carboxamide

ZLS, (1S)-N-[(1S)-7,7-dihydroxy-1-{4-[(1R,4S)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-6-yl]-1H-imidazol-2-yl}nonyl]-6-methyl-6-azaspiro[2.5]octane-1-carboxamide (C32 H46 N4 O3, 534.8 g/mol), in the MolNFT structures on GenesisL1: bound in…

Component
ZLS
Formula
C32 H46 N4 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

ZLS in 2 structures; the first of them:

  • 7MOX · Structure of HDAC2 in complex with an inhibitor (compound 14) · ZLS A411 · binds GLY28, HIS29, PRO30, MET31, GLU99, ASP100, HIS141, HIS142 and 10 more
  • 7MOX · Structure of HDAC2 in complex with an inhibitor (compound 14) · ZLS A411 · binds GLY28, HIS29, PRO30, MET31, GLU99, ASP100, HIS141, HIS142 and 10 more

Residues it binds most

GLY 6, HIS 6, ASP 6, PHE 6, GLU 6, LEU 6, MET 6, PRO 6, TYR 6, CYS 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • PEG · Di(hydroxyethyl)ether

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