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Ligand · 0LS

0LS · N-{[(3S,4S)-4-benzylpyrrolidin-3-yl]methyl}-4-chloro-N-phenylaniline

0LS, N-{[(3S,4S)-4-benzylpyrrolidin-3-yl]methyl}-4-chloro-N-phenylaniline (C24 H25 Cl N2, 376.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
0LS
Formula
C24 H25 Cl N2
Class
ligand
Structures
2
PDB entries
1

Binding sites

0LS in 2 structures; the first of them:

  • 4GJ6 · Crystal structure of renin in complex with NVP-AYZ832 (compound 6a) · 0LS A1001 · binds VAL30, ASP32, GLY34, SER35, TYR75, PRO111, PHE112, PHE117 and 11 more
  • 4GJ6 · Crystal structure of renin in complex with nvp-AYZ832 (compound 6A) · 0LS A1001 · binds VAL30, ASP32, GLY34, SER35, TYR75, PRO111, PHE112, PHE117 and 11 more

Residues it binds most

LEU 8, PHE 8, SER 8, TYR 8, PRO 8, THR 8, ALA 8, ASP 4, GLY 4, VAL 4 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • SO4 · Sulfate ion

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