Ligand · K5Q
K5Q · (2S)-6-[(E)-[(2E)-2-hydroxyimino-3H-inden-1-ylidene]methyl]-2-(3-hydroxy-3-oxopropyl)-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid
K5Q, (2S)-6-[(E)-[(2E)-2-hydroxyimino-3H-inden-1-ylidene]methyl]-2-(3-hydroxy-3-oxopropyl)-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid (C22 H19 N O7, 409.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…
- Component
- K5Q
- Formula
- C22 H19 N O7
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
K5Q in 2 structures; the first of them:
- 4CGG · Interrogating HIV integrase for compounds that bind- a SAMPL challenge · K5Q B1217 · binds GLN95, GLU96, ALA98, TYR99, LEU102, THR125, ALA128, ALA129 and 8 more
- 4CGG · Interrogating HIV integrase for compounds that bind- a sampl challenge · K5Q B1217 · binds GLN95, GLU96, ALA98, TYR99, LEU102, THR125, ALA128, ALA129 and 8 more
Residues it binds most
ALA 4, GLN 4, GLU 4, THR 4, HIS 4, LEU 4, LYS 4, MET 4, TRP 4, TYR 4 (residue and the binding sites it lines).
Found with
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