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Ligand · M32

M32 · N-(benzylsulfonyl)-D-alanyl-N-[2-(aminomethyl)-5-chlorobenzyl]-L-prolinamide

M32, N-(benzylsulfonyl)-D-alanyl-N-[2-(aminomethyl)-5-chlorobenzyl]-L-prolinamide (C23 H29 Cl N4 O4 S, 493.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
M32
Formula
C23 H29 Cl N4 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

M32 in 2 structures; the first of them:

  • 3RMM · Human Thrombin in complex with MI332 · M32 H1 · binds HIS57, TYR60A, TRP60D, LEU99, ASP189, ALA190, CYS191, GLU192 and 12 more
  • 3RMM · Human thrombin in complex with MI332 · M32 H1 · binds HIS57, TYR60A, TRP60D, LEU99, ASP189, ALA190, CYS191, GLU192 and 12 more

Residues it binds most

GLY 2, CYS 2, GLU 2, SER 2, TRP 2, TYR 2, ALA 2, ARG 2, ASP 2, HIS 2 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • PO4 · Phosphate ion
  • GOL · Glycerol

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