AA donor | Acceptor ligand | δ (Å) | θ1 | θ2 |
N/ALA456 | S/3S | 3.303 | 125.60 | 94.16 |
N/ALA456 | Se/3Se | 3.340 | 165.25 | 98.30 |
O/VAL455 | Se/3Se | 3.272 | 141.30. | 113.22 |
O/TYR61 | Se/9Se | 3.128 | 145.40 | 89.36 |
O/TYR61 | Se/9Se | 3.299 | 147.46 | 90.49 |
O/TYR61 | Se/9Se | 3.155 | 137.45 | 88.43 |