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Ligand · 0ME

0ME · (3S)-N-(9H-xanthen-9-ylmethyl)piperidine-3-carboxamide

0ME, (3S)-N-(9H-xanthen-9-ylmethyl)piperidine-3-carboxamide (C20 H22 N2 O2, 322.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
0ME
Formula
C20 H22 N2 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

0ME in 2 structures; the first of them:

  • 4GJB · Crystal structure of renin in complex with NVP-BBV031 (compound 6) · 0ME A1001 · binds GLN13, VAL30, ASP32, GLY34, SER35, TYR75, SER76, THR77 and 8 more
  • 4GJB · Crystal structure of renin in complex with nvp-BBV031 (compound 6) · 0ME A1001 · binds GLN13, VAL30, ASP32, GLY34, SER35, TYR75, SER76, THR77 and 8 more

Residues it binds most

ASP 4, GLY 4, PHE 4, SER 4, VAL 4, ALA 4, GLN 4, PRO 4, TYR 4, LEU 2 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • SO4 · Sulfate ion

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