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Ligand · 185

185 · (6-[4-(aminomethyl)-2,6-dimethylphenoxy]-2-{[4-(aminomethyl)phenyl]amino}-5-bromopyrimidin-4-yl)methanol

185, (6-[4-(aminomethyl)-2,6-dimethylphenoxy]-2-{[4-(aminomethyl)phenyl]amino}-5-bromopyrimidin-4-yl)methanol (C21 H16 Br N5 O2, 450.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
185
Formula
C21 H16 Br N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

185 in 2 structures; the first of them:

  • 1SUQ · Crystal structure of HIV-1 reverse transcriptase (rt) in complex with janssen-R185545 · 185 A600 · binds PRO95, LEU100, LYS101, LYS103, VAL106, VAL179, TYR181, TYR188 and 9 more
  • 1SUQ · Crystal structure of HIV-1 reverse transcriptase (rt) in complex with janssen-R185545 · 185 A600 · binds PRO95, LEU100, LYS101, LYS103, VAL106, VAL179, TYR181, TYR188 and 9 more

Residues it binds most

TYR 2, VAL 2, LEU 2, LYS 2, PRO 2, GLU 2, GLY 2, HIS 2, PHE 2, TRP 2 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion

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