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Ligand · 0LK

0LK · N-[(1S,2S)-2-carbamimidamido-2,3-dihydro-1H-inden-1-yl]-N'-(4-chloro-3-fluorophenyl)ethanediamide

0LK, N-[(1S,2S)-2-carbamimidamido-2,3-dihydro-1H-inden-1-yl]-N'-(4-chloro-3-fluorophenyl)ethanediamide (C18 H17 Cl F N5 O2, 389.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
0LK
Formula
C18 H17 Cl F N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

0LK in 2 structures; the first of them:

  • 4DKQ · Crystal structure of clade A/E 93TH057 HIV-1 gp120 core in complex with DMJ-I-228 · 0LK A613 · binds TRP112, VAL255, SER256, THR257, ASP368, GLU370, ILE371, SER375 and 11 more
  • 4DKQ · Crystal structure of clade A/E 93TH057 HIV-1 GP120 core in complex with dmj-I-228 · 0LK A613 · binds TRP112, VAL255, SER256, THR257, ASP368, GLU370, ILE371, SER375 and 11 more

Residues it binds most

ASN 2, ILE 2, GLY 2, PHE 2, SER 2, TRP 2, ASP 2, GLU 2, MET 2, THR 2 (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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