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Ligand · 3ZK

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

3ZK, 4-methoxy-3-(3-methoxypropoxy)-N-{[(3S,4S)-4-{[(4-methylphenyl)sulfonyl]amino}pyrrolidin-3-yl]methyl}-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).…

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

Binding sites

3ZK in 2 structures; the first of them:

  • 4RYC · RENIN IN COMPLEXED WITH 4-methoxy-3-(3-methoxypropoxy)-N-{[(3S,4S)-4-{[(4-methylphenyl)sul… · 3ZK A1001 · binds THR12, GLN13, TYR14, VAL30, ASP32, GLY34, SER35, TRP39 and 21 more
  • 4RYC · Renin in complexed with 4-methoxy-3-(3-methoxypropoxy)-N-{[(3S,4S)-4… · 3ZK A1001 · binds THR12, GLN13, TYR14, VAL30, ASP32, GLY34, SER35, TRP39 and 21 more

Residues it binds most

THR 4, ALA 4, SER 4, TYR 4, ASP 4, GLN 4, GLY 4, LEU 4, PHE 4, VAL 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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