Table 1.
mTBA residue | Hydrogen bonds |
Hydrophobic interaction |
|||
---|---|---|---|---|---|
Atom | Thrombin residue | Atom | Distance (Å) | Thrombin residue | |
Gua2 | O2P | Arg77A | NH1, NH2 | 3.17, 3.27 | |
Thy3 | – | – | – | – | Tyr76, Leu65, Ile82 |
Thy4 | O4′ | Tyr76 | N | 2.83 | Tyr76 |
Thy4 | O2 | Arg75 | NH2 | 3.07 | |
Thy4 | O4 | Arg77A | NH1 | 2.90 | |
Thy12 | N3 | Glu77 | OE2 | 2.88 | Ile79 |
Thy13 | O4 | Arg75 | NH1, NH2 | 3.15, 2.57 | Asn78, Ile79 |
Thy13 | O3′ | Asn78 | ND2 | 2.81 |