Table 1.
Hydrogen bonds between DTIP and thrombin.
| Name | Types | Distance | From | To |
|---|---|---|---|---|
| DTIP: TYR3: HN-H: GLY216: O | Conventional hydrogen bond | 2.01748 | DTIP:TYR3:HN | H: GLY216: O |
| H: GLU217: CA-DTIP: TYR3: O | Carbon hydrogen bond | 3.11836 | H:GLU217:CA | DTIP: TYR3: O |
| H: GLY219: HN-DTIP: TYR3: O | Conventional hydrogen bond | 2.37161 | H:GLY219:HN | DTIP: TYR3: O |
| H: ARG73: HH22-DTIP: ASP24: OD2 | Conventional hydrogen bond | 2.41177 | H:ARG73:HH22 | DTIP: ASP24: OD2 |
| H: LYS36: HZ2-DTIP: GLU35: OCT1 | Conventional hydrogen bond | 2.04514 | H:LYS36:HZ2 | DTIP: GLU35: OCT1 |
| DTIP: VAL1: HT1-H: HIS57: NE2 | Conventional hydrogen bond | 2.73262 | DTIP:VAL1:HT1 | H: HIS57: NE2 |
| DTIP: VAL1: HT2-H: HIS57 | Pi-Donor hydrogen bond | 2.38777 | DTIP:VAL1:HT2 | H: HIS57 |
| DTIP: VAL1: HT1-H: SER195: OG | Conventional hydrogen bond | 2.00852 | DTIP:VAL1:HT1 | H: SER195: OG |
| DTIP: VAL1: HT3-H: SER214: O | Conventional hydrogen bond | 1.72359 | DTIP:VAL1:HT3 | H: SER214: O |
| H: GLY216: HN-DTIP: VAL1: O | Conventional hydrogen bond | 2.55263 | H:GLY216:HN | DTIP: VAL1: O |
| H: ARG221A: HH12-DTIP: ASP5: OD2 | Salt bridge | 2.7241 | H:ARG221A:HH12 | DTIP: ASP5: OD2 |
| H: TRP60D: HE1-DTIP: GLN18: O | Conventional hydrogen bond | 2.77242 | H:TRP60D:HE1 | DTIP: GLN18: O |
| H: SER36A: CB-DTIP: ASP34: OD2 | Carbon hydrogen bond | 3.72795 | H:SER36A:CB | DTIP: ASP34: OD2 |
There are hydrogen bonds between DTIP and the heavy chain of thrombin (H). In this table, we displayed the atoms of amino acid residues in the peptide chain where hydrogen bond was formed. The types, bond length, and orientation of hydrogen bond were also shown