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Ligand · 3ZM

3ZM · 5-(4-chlorophenyl)-N-{(S)-[5-(hydroxymethyl)-4-methyl-1,3-thiazol-2-yl][(2R)-piperidin-2-yl]methyl}-1H-pyrrole-2-carboxamide

3ZM, 5-(4-chlorophenyl)-N-{(S)-[5-(hydroxymethyl)-4-methyl-1,3-thiazol-2-yl][(2R)-piperidin-2-yl]methyl}-1H-pyrrole-2-carboxamide (C22 H25 Cl N4 O2 S, 445.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
3ZM
Formula
C22 H25 Cl N4 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

3ZM in 2 structures; the first of them:

  • 4RZ8 · Crystal structure of HIV-1 gp120 core in complex with NBD-11021, a small molecule… · 3ZM A510 · binds TRP112, VAL255, SER256, THR257, ASP368, GLU370, ILE371, SER375 and 12 more
  • 4RZ8 · Crystal structure of HIV-1 GP120 core in complex with nbd-11021, a small molecule… · 3ZM A510 · binds TRP112, VAL255, SER256, THR257, ASP368, GLU370, ILE371, SER375 and 12 more

Residues it binds most

ILE 8, ASN 8, GLY 8, PHE 8, SER 8, TRP 8, ASP 8, GLN 8, GLU 8, MET 8 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid

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