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Ligand · BJM

BJM · (2~{S})-2-azanyl-1-[(1~{S},3~{S},5~{S})-3-(iminomethyl)-2-azabicyclo[3.1.0]hexan-2-yl]-2-[(5~{R},7~{S})-3-oxidanyl-1-ad amantyl]ethanone

BJM, (2~{S})-2-azanyl-1-[(1~{S},3~{S},5~{S})-3-(iminomethyl)-2-azabicyclo[3.1.0]hexan-2-yl]-2-[(5~{R},7~{S})-3-oxidanyl-1-ad amantyl]ethanone (C18 H27 N3 O2, 317.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
BJM
Formula
C18 H27 N3 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

BJM in 2 structures; the first of them:

  • 3BJM · Crystal structure of human DPP-IV in complex with (1S,3S… · BJM A1 · binds ARG125, GLU205, GLU206, PHE357, TYR547, SER630, TYR631, VAL656 and 6 more
  • 3BJM · Crystal structure of human dpp-IV in complex with (1S,3S, 5S)-2-[(2S)… · BJM A1 · binds ARG125, GLU205, GLU206, PHE357, TYR547, SER630, TYR631, VAL656 and 6 more

Residues it binds most

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

Found with

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

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