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Ligand · 0X3

0X3 · N-(3-chloro-5-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine

0X3, N-(3-chloro-5-fluorophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine (C12 H6 Cl F N4 O3, 308.6 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the…

Component
0X3
Formula
C12 H6 Cl F N4 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

0X3 in 4 structures; the first of them:

  • 4GHI · Crystal structure of the high affinity heterodimer of HIF2 alpha and ARNT C-terminal PAS… · 0X3 A401 · binds PHE244, SER246, HIS248, MET252, PHE254, ALA277, PHE280, TYR281 and 13 more
  • 4ZQD · Crystal Structure of the Heterodimeric HIF-2a:ARNT Complex with the Benzoxadiazole… · 0X3 B401 · binds PHE244, SER246, HIS248, MET252, PHE254, ILE261, ALA277, PHE280 and 9 more
  • 4GHI · Crystal structure of the high affinity heterodimer of HIF2 alpha and arnt C-terminal pas… · 0X3 A401 · binds PHE244, SER246, HIS248, MET252, PHE254, ALA277, PHE280, TYR281 and 13 more
  • 4ZQD · Crystal structure of the heterodimeric hif-2A:ARNT complex with the benzoxadiazole… · 0X3 B401 · binds PHE244, SER246, HIS248, MET252, PHE254, ILE261, ALA277, PHE280 and 9 more

Residues it binds most

PHE 4, MET 4, HIS 4, SER 4, TYR 4, ILE 4, LEU 4, ALA 4, ASN 4, CYS 4 (residue and the binding sites it lines).

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