| Table S1.13. Fragment 13 interactions with Asp |
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Listed below are the
ligands in the PDB that contain the chemical fragment shown on the
left and which interact via this fragment with the side chain of a
Asp residue via hydrogen bonds.
The PDB codes are hyperlinked to a schematic LIGPLOT diagram in PDBsum. |
| Ligand | Description | |||||||||||||||||||||||
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1. Ligand: 344 6-amino-3,7-dihydro-imidazo[4,5-g]quinazolin-8-one PDB code: 2bbf. |
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2. Ligand: BGU 2,6-diamino-1,7-dihydro-8h-imidazo[4,5-g]quinazolin-8-one PDB code: 2z7k. |
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3. Ligand: CKR 6-amino-2-[(2-morpholin-4-ylethyl)amino]-3,7-dihydro-8h-imidazo[4,5-g]quinazolin-8-one PDB code: 3c2n. |
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4. Ligand: E89 6-amino-4-[2-(4-methoxyphenyl)ethyl]-1,7-dihydro-8h-imidazo[4,5-g]quinazolin-8-one PDB code: 1y5x. |
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5. Ligand: NE8 6-amino-4-(2-phenylethyl)-1,7-dihydro-8h-imidazo[4,5-g]quinazolin-8-one PDB code: 1y5v. |
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6. Ligand: NEZ 6-amino-4-[2-(4-methylphenyl)ethyl]-1,7-dihydro-8h-imidazo[4,5-g]quinazolin-8-one PDB code: 1y5w. |
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7. Ligand: S60 6-amino-2-methyl-1,7-dihydro-8h-imidazo[4,5-g]quinazolin-8-one PDB code: 3c2y. |
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8. Ligand: S79 6-amino-2-[(1-naphthylmethyl)amino]-3,7-dihydro-8h-imidazo[4,5-g]quinazolin-8-one PDB code: 2qzr. |
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9. Ligand: S98 6-amino-2-[(thiophen-2-ylmethyl)amino]-1,7-dihydro-8h-imidazo[4,5-g]quinazolin-8-one PDB code: 3c2z. |
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