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Ligand · 5MA

5MA · 1-(2,5-dichloro-3-{[5-chloro-1-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-1H-benzotriazol-4-yl]oxy}phenyl)methanamine

5MA, 1-(2,5-dichloro-3-{[5-chloro-1-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-1H-benzotriazol-4-yl]oxy}phenyl)methanamine (C20 H14 Cl3 N7 O, 474.7 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every…

Component
5MA
Formula
C20 H14 Cl3 N7 O
Class
ligand
Structures
4
PDB entries
2

Binding sites

5MA in 4 structures; the first of them:

  • 3T19 · Crystal structure of HIV-1 reverse transcriptase (wild type) in complex with inhibitor M05 · 5MA A561 · binds PRO95, LEU100, LYS101, LYS102, LYS103, VAL106, VAL108, VAL179 and 11 more
  • 3T1A · Crystal Structure of HIV-1 Reverse Transcriptase (K103N mutant) in Complex with Inhibitor… · 5MA A561 · binds PRO95, LEU100, LYS101, LYS102, ASN103, VAL106, VAL108, VAL179 and 11 more
  • 3T19 · Crystal structure of HIV-1 reverse transcriptase (wild type) in complex with inhibitor M05 · 5MA A561 · binds PRO95, LEU100, LYS101, LYS102, LYS103, VAL106, VAL108, VAL179 and 11 more
  • 3T1A · Crystal structure of HIV-1 reverse transcriptase (K103N mutant) in complex with inhibitor… · 5MA A561 · binds PRO95, LEU100, LYS101, LYS102, ASN103, VAL106, VAL108, VAL179 and 11 more

Residues it binds most

VAL 4, PRO 4, TYR 4, LYS 4, LEU 4, GLY 4, HIS 4, PHE 4, TRP 4, ASN 2 (residue and the binding sites it lines).

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