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Ligand · M51

M51 · {(2S,4S)-4-[4-(3-methyl-1-phenyl-1H-pyrazol-5-yl)piperazin-1-yl]pyrrolidin-2-yl}(1,3-thiazolidin-3-yl)methanone

M51, {(2S,4S)-4-[4-(3-methyl-1-phenyl-1H-pyrazol-5-yl)piperazin-1-yl]pyrrolidin-2-yl}(1,3-thiazolidin-3-yl)methanone (C22 H30 N6 O S, 426.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
M51
Formula
C22 H30 N6 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

M51 in 2 structures; the first of them:

  • 3VJK · Crystal structure of human depiptidyl peptidase IV (DPP-4) in complex with MP-513 · M51 A1000 · binds ARG125, GLU205, GLU206, VAL207, PHE208, SER209, PHE357, ARG358 and 11 more
  • 3VJK · Crystal structure of human depiptidyl peptidase IV (dpp-4) in complex with mp-513 · M51 A1000 · binds ARG125, GLU205, GLU206, VAL207, PHE208, SER209, PHE357, ARG358 and 11 more

Residues it binds most

TYR 4, VAL 4, ARG 4, GLU 4, PHE 4, SER 4, ASN 4, HIS 4, TRP 4 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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