GL1X · GenesisL1 explorer

Ligand · 3ZJ

3ZJ · N-({(3S,4S)-4-[(benzylsulfonyl)amino]pyrrolidin-3-yl}methyl)-4-methoxy-3-(3-methoxypropoxy)-N-(propan-2-yl)benzamide

3ZJ, N-({(3S,4S)-4-[(benzylsulfonyl)amino]pyrrolidin-3-yl}methyl)-4-methoxy-3-(3-methoxypropoxy)-N-(propan-2-yl)benzamide (C27 H39 N3 O6 S, 533.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
3ZJ
Formula
C27 H39 N3 O6 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

3ZJ in 2 structures; the first of them:

  • 4RYG · RENIN IN COMPLEXED WITH N-({(3S,4S)-4-[(benzylsulfonyl)amino]pyrrolidin-3-yl}methyl)-4-met… · 3ZJ A1001 · binds THR12, GLN13, TYR14, VAL30, ASP32, GLY34, SER35, TYR75 and 20 more
  • 4RYG · Renin in complexed with N-({(3S,4S)-4-[(benzylsulfonyl)… · 3ZJ A1001 · binds THR12, GLN13, TYR14, VAL30, ASP32, GLY34, SER35, TYR75 and 20 more

Residues it binds most

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

Found with

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

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