Table 5 Types of interactions in the Palomid 529–4JT6 (mTOR) receptor complex
From: A theoretical insight in interactions of some chemical compounds as mTOR inhibitors
Distance | Types | From | From Chemistry | To | To Chemistry |
|---|---|---|---|---|---|
1.650 | Conventional Hydrogen Bond | A:TYR867:HH | H-Donor | :RES1:O3 | H-Acceptor |
2.300 | Conventional Hydrogen Bond | :RES1:H22 | H-Donor | A:VAL882:O | H-Acceptor |
2.487 | Carbon Hydrogen Bond | A:ASP964:HA | H-Donor | :RES1:O2 | H-Acceptor |
2.301 | Carbon Hydrogen Bond | :RES1:H13 | H-Donor | :RES1:O2 | H-Acceptor |
2.969 | Carbon Hydrogen Bond | :RES1:H5 | H-Donor | A:ASP837:O | H-Acceptor |
2.514 | Carbon Hydrogen Bond | :RES1:H7 | H-Donor | A:ASP837:O | H-Acceptor |
2.072 | Carbon Hydrogen Bond | :RES1:H9 | H-Donor | A:GLU836:OE1 | H-Acceptor |
3.481 | Pi–Anion | A:ASP964:OD1 | Negative | :RES1 | Pi-Orbitals |
2.927 | Pi–Donor Hydrogen Bond | A:ASP964:HN | H-Donor | :RES1 | Pi-Orbitals |
5.382 | Pi–Pi T-shaped | A:TYR867 | Pi-Orbitals | :RES1 | Pi-Orbitals |
4.250 | Pi–Alkyl | :RES1 | Pi-Orbitals | A:ILE879 | Alkyl |
4.362 | Pi–Alkyl | :RES1 | Pi-Orbitals | A:ILE963 | Alkyl |
4.998 | Pi–Alkyl | :RES1 | Pi-Orbitals | A:LEU831 | Alkyl |
4.904 | Pi–Alkyl | :RES1 | Pi-Orbitals | A:ILE879 | Alkyl |
3.954 | Pi–Alkyl | :RES1 | Pi-Orbitals | A:ILE963 | Alkyl |
5.354 | Pi–Alkyl | :RES1 | Pi-Orbitals | A:LEU831 | Alkyl |
5.417 | Pi–Alkyl | :RES1 | Pi-Orbitals | A:ILE879 | Alkyl |
4.342 | Pi–Alkyl | :RES1 | Pi-Orbitals | A:ILE963 | Alkyl |