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Ligand · MWD

MWD · (3S)-N~3~-(4-chloro-3-fluorophenyl)-N~1~-propylpiperidine-1,3-dicarboxamide

MWD, (3S)-N~3~-(4-chloro-3-fluorophenyl)-N~1~-propylpiperidine-1,3-dicarboxamide (C16 H21 Cl F N3 O2, 341.8 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
MWD
Formula
C16 H21 Cl F N3 O2
Class
ligand
Structures
1
PDB entries
1

Binding sites

MWD in 1 structure; the first of them:

  • 6ONH · Crystal structure of HIV-1 LM/HT clade A/E CRF01 GP120 core in complex with… · MWD A511 · binds VAL255, SER256, THR257, GLU370, THR375, PHE376, ASN377, PHE382 and 6 more

Residues it binds most

ASN 1, GLY 1, PHE 1, THR 1, ASP 1, GLU 1, MET 1, SER 1, TRP 1, VAL 1 (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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