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Ligand · A7A

A7A · (R)-{1-[(2,5-dimethylphenyl)methyl]-6-(1-methyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-yl}(pyridin-4-yl) methanol

A7A, (R)-{1-[(2,5-dimethylphenyl)methyl]-6-(1-methyl-1H-pyrazol-4-yl)-1H-benzimidazol-2-yl}(pyridin-4-yl) methanol (C26 H25 N5 O, 423.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
A7A
Formula
C26 H25 N5 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

A7A in 2 structures; the first of them:

  • 6OP0 · Asymmetric hTNF-alpha · A7A C201 · binds LEU57, TYR59, TYR119, GLY121, VAL123, ILE155, LEU157, LEU57 and 15 more
  • 6OP0 · Asymmetric htnf-alpha · A7A C201 · binds LEU57, TYR59, TYR119, VAL123, ILE155, LEU157, LEU57, TYR119 and 11 more

Residues it binds most

TYR 2, LEU 2, GLY 2, ILE 2, GLN 2, SER 2, VAL 2 (residue and the binding sites it lines).

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