Ligand · 2KW
2KW · 3-chloro-5-({1-[(4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]-2-oxo-4-(trifluoromethyl)-1,2-dihydropyridin-3-yl}oxy)benzonitrile
2KW, 3-chloro-5-({1-[(4-methyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]-2-oxo-4-(trifluoromethyl)-1,2-dihydropyridin-3-yl}oxy)benzonitrile (C17 H11 Cl F3 N5 O3, 425.8 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records…
- Component
- 2KW
- Formula
- C17 H11 Cl F3 N5 O3
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
2KW in 4 structures; the first of them:
- 7Z2G · Cryo-EM structure of HIV-1 reverse transcriptase with a DNA aptamer in complex with… · 2KW A601 · binds PRO95, LEU100, LYS101, LYS102, LYS103, VAL106, VAL108, VAL179 and 12 more
- 7Z2H · Cryo-EM structure of NNRTI resistant M184I/E138K mutant HIV-1 reverse transcriptase with… · 2KW A601 · binds PRO95, LEU100, LYS101, LYS103, LYS104, VAL106, VAL179, TYR181 and 11 more
- 7Z2G · Cryo-EM structure of HIV-1 reverse transcriptase with a DNA aptamer in complex with… · 2KW A601 · binds PRO95, LEU100, LYS101, LYS102, LYS103, VAL106, VAL108, VAL179 and 12 more
- 7Z2H · Cryo-EM structure of nnrti resistant M184I/E138K mutant HIV-1 reverse transcriptase with… · 2KW A601 · binds PRO95, LEU100, LYS101, LYS103, LYS104, VAL106, VAL179, TYR181 and 11 more
Residues it binds most
TYR 4, VAL 4, LEU 4, LYS 4, PRO 4, GLY 4, HIS 4, PHE 4, TRP 4 (residue and the binding sites it lines).
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