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Ligand · 3DI

3DI · 3-(1~{H}-pyrazol-5-yl)aniline

3DI, 3-(1~{H}-pyrazol-5-yl)aniline (C9 H9 N3, 159.2 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
3DI
Formula
C9 H9 N3
Class
ligand
Structures
1
PDB entries
1

Binding sites

3DI in 1 structure; the first of them:

  • 7OYJ · Crystal structure of HTEAD2 in complex with fragment at the interface 2 · 3DI B501 · binds VAL237, GLU238, PRO239, PRO240, GLN247, HIS249, TRP308, GLY324

Residues it binds most

PRO 1, GLN 1, GLU 1, GLY 1, HIS 1, TRP 1, VAL 1 (residue and the binding sites it lines).

Found with

  • PLM · Palmitic acid

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