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Ligand · 0LJ

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

0LJ, N-[(1R,2R)-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
0LJ
Formula
C18 H17 Cl F N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

0LJ in 2 structures; the first of them:

  • 4DKR · Crystal structure of clade A/E 93TH057 HIV-1 gp120 core in complex with AWS-I-169 · 0LJ A513 · binds VAL255, SER256, THR257, ASP368, GLU370, ILE371, SER375, PHE376 and 12 more
  • 4DKR · Crystal structure of clade A/E 93TH057 HIV-1 GP120 core in complex with aws-I-169 · 0LJ A513 · binds VAL255, SER256, THR257, ASP368, GLU370, ILE371, SER375, PHE376 and 12 more

Residues it binds most

GLY 4, ILE 4, ASN 4, PHE 4, SER 4, TRP 4, ASP 4, GLN 4, GLU 4, MET 4 (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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