1G7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OHA | CZA | sing | 1.36Å | 1.35Å | |
| CZA | CE2 | doub | 1.39Å | 1.41Å | Aromatic |
| CZA | CE1 | sing | 1.39Å | 1.43Å | Aromatic |
| CE2 | CD2 | sing | 1.38Å | 1.40Å | Aromatic |
| OH4 | CE4 | sing | 1.36Å | 1.38Å | |
| OHB | CZB | sing | 1.36Å | 1.40Å | |
| CE1 | CD1 | doub | 1.38Å | 1.40Å | Aromatic |
| CZB | CE4 | doub | 1.39Å | 1.39Å | Aromatic |
| CZB | CE3 | sing | 1.39Å | 1.45Å | Aromatic |
| CE4 | CD4 | sing | 1.39Å | 1.36Å | Aromatic |
| CE3 | CD3 | doub | 1.38Å | 1.42Å | Aromatic |
| CD4 | CGB | doub | 1.38Å | 1.44Å | Aromatic |
| CD3 | CGB | sing | 1.38Å | 1.38Å | Aromatic |
| CGB | CBB | sing | 1.51Å | 1.55Å | |
| CD2 | CGA | doub | 1.38Å | 1.41Å | Aromatic |
| CD1 | CGA | sing | 1.38Å | 1.38Å | Aromatic |
| CBB | CAB | sing | 1.53Å | 1.59Å | |
| CGA | CBA | sing | 1.51Å | 1.53Å | |
| CAB | NB | sing | 1.46Å | 1.46Å | |
| CAB | CB | sing | 1.50Å | 1.51Å | |
| NB | CA | sing | 1.34Å | 1.33Å | |
| OB | CB | doub | 1.21Å | 1.24Å | |
| CBA | CAA | sing | 1.53Å | 1.53Å | |
| CB | NA | sing | 1.34Å | 1.32Å | |
| CA | OA | doub | 1.21Å | 1.25Å | |
| CA | CAA | sing | 1.50Å | 1.54Å | |
| NA | CAA | sing | 1.46Å | 1.47Å | |
| CAB | H1 | sing | 1.09Å | 1.10Å | |
| CBB | H2 | sing | 1.09Å | 1.10Å | |
| CBB | H3 | sing | 1.09Å | 1.10Å | |
| CD4 | H4 | sing | 1.08Å | 1.08Å | |
| OH4 | H5 | sing | 0.97Å | 0.95Å | |
| OHB | H6 | sing | 0.97Å | 0.95Å | |
| CE3 | H7 | sing | 1.08Å | 1.08Å | |
| CD3 | H8 | sing | 1.08Å | 1.08Å | |
| NB | H9 | sing | 0.97Å | 1.00Å | |
| NA | H10 | sing | 0.97Å | 1.00Å | |
| CAA | H11 | sing | 1.09Å | 1.10Å | |
| CBA | H12 | sing | 1.09Å | 1.10Å | |
| CBA | H13 | sing | 1.09Å | 1.10Å | |
| CD1 | H14 | sing | 1.08Å | 1.08Å | |
| CE1 | H15 | sing | 1.08Å | 1.08Å | |
| OHA | H16 | sing | 0.97Å | 0.95Å | |
| CE2 | H17 | sing | 1.08Å | 1.08Å | |
| CD2 | H18 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OHA | CZA | CE2 | 123.0° | 120.1° |
| OHA | CZA | CE1 | 119.0° | 120.1° |
| CZA | OHA | H16 | 109.5° | 114.0° |
| CE2 | CZA | CE1 | 117.9° | 119.9° |
| CZA | CE2 | CD2 | 123.5° | 119.9° |
| CZA | CE2 | H17 | 118.3° | 120.0° |
| CZA | CE1 | CD1 | 116.5° | 120.0° |
| CZA | CE1 | H15 | 121.8° | 120.0° |
| CE2 | CD2 | CGA | 119.0° | 120.1° |
| CD2 | CE2 | H17 | 118.2° | 120.1° |
| CE2 | CD2 | H18 | 120.5° | 119.9° |
| OH4 | CE4 | CZB | 117.7° | 120.1° |
| OH4 | CE4 | CD4 | 119.9° | 120.1° |
| CE4 | OH4 | H5 | 109.5° | 114.0° |
| OHB | CZB | CE4 | 120.7° | 120.0° |
| OHB | CZB | CE3 | 119.6° | 120.1° |
| CZB | OHB | H6 | 109.5° | 114.0° |
| CE1 | CD1 | CGA | 126.3° | 120.0° |
| CE1 | CD1 | H14 | 116.9° | 120.0° |
| CD1 | CE1 | H15 | 121.7° | 120.1° |
| CE4 | CZB | CE3 | 119.7° | 119.9° |
| CZB | CE4 | CD4 | 122.3° | 119.8° |
| CZB | CE3 | CD3 | 117.9° | 120.0° |
| CZB | CE3 | H7 | 121.1° | 120.0° |
| CE4 | CD4 | CGB | 118.7° | 120.0° |
| CE4 | CD4 | H4 | 120.6° | 120.0° |
| CE3 | CD3 | CGB | 120.3° | 120.1° |
| CD3 | CE3 | H7 | 121.1° | 120.0° |
| CE3 | CD3 | H8 | 119.8° | 120.0° |
| CD4 | CGB | CD3 | 120.9° | 120.1° |
| CD4 | CGB | CBB | 119.8° | 119.9° |
| CGB | CD4 | H4 | 120.7° | 119.9° |
| CD3 | CGB | CBB | 119.3° | 119.9° |
| CGB | CD3 | H8 | 119.9° | 119.9° |
| CGB | CBB | CAB | 107.2° | 109.5° |
| CGB | CBB | H2 | 110.0° | 109.5° |
| CGB | CBB | H3 | 110.1° | 109.5° |
| CD2 | CGA | CD1 | 116.7° | 120.1° |
| CD2 | CGA | CBA | 119.3° | 119.9° |
| CGA | CD2 | H18 | 120.5° | 120.0° |
| CD1 | CGA | CBA | 123.9° | 120.0° |
| CGA | CD1 | H14 | 116.8° | 119.9° |
| CBB | CAB | NB | 108.0° | 109.1° |
| CBB | CAB | CB | 109.5° | 109.1° |
| CBB | CAB | H1 | 107.3° | 109.1° |
| CAB | CBB | H2 | 110.0° | 109.4° |
| CAB | CBB | H3 | 110.0° | 109.4° |
| CGA | CBA | CAA | 112.4° | 109.4° |
| CGA | CBA | H12 | 108.7° | 109.5° |
| CGA | CBA | H13 | 108.7° | 109.5° |
| NB | CAB | CB | 114.6° | 111.3° |
| CAB | NB | CA | 127.1° | 122.8° |
| NB | CAB | H1 | 108.9° | 109.1° |
| CAB | NB | H9 | 116.4° | 118.6° |
| CAB | CB | OB | 118.2° | 118.7° |
| CAB | CB | NA | 118.3° | 122.7° |
| CB | CAB | H1 | 108.3° | 109.1° |
| NB | CA | OA | 124.0° | 118.6° |
| NB | CA | CAA | 118.0° | 122.7° |
| CA | NB | H9 | 116.4° | 118.6° |
| OB | CB | NA | 123.5° | 118.6° |
| CBA | CAA | CA | 109.2° | 109.1° |
| CBA | CAA | NA | 110.8° | 109.3° |
| CBA | CAA | H11 | 107.5° | 109.0° |
| CAA | CBA | H12 | 108.7° | 109.4° |
| CAA | CBA | H13 | 108.7° | 109.5° |
| CB | NA | CAA | 127.4° | 122.8° |
| CB | NA | H10 | 116.3° | 118.6° |
| OA | CA | CAA | 118.0° | 118.7° |
| CA | CAA | NA | 113.4° | 111.2° |
| CA | CAA | H11 | 107.4° | 109.1° |
| CAA | NA | H10 | 116.3° | 118.6° |
| NA | CAA | H11 | 108.2° | 109.0° |
| H2 | CBB | H3 | 109.5° | 109.5° |
| H12 | CBA | H13 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OHA | CZA | CE2 | CE1 | 179.6° | 179.8° |
| OHA | CZA | CE2 | CD2 | 179.8° | 180.0° |
| OHA | CZA | CE1 | CD1 | 179.9° | 179.7° |
| OHA | CZA | CE1 | H15 | 0.1° | 0.1° |
| OHA | CZA | CE2 | H17 | 0.2° | 0.2° |
| CZA | CE2 | CD2 | H17 | 180.0° | 179.8° |
| CE2 | CZA | CE1 | CD1 | 0.3° | 0.1° |
| CZA | CE2 | CD2 | CGA | 1.6° | 0.5° |
| CE2 | CZA | CE1 | H15 | 179.7° | 180.0° |
| CE2 | CZA | OHA | H16 | 180.0° | 90.0° |
| CZA | CE2 | CD2 | H18 | 178.4° | 180.0° |
| CE1 | CZA | CE2 | CD2 | 0.6° | 0.2° |
| CZA | CE1 | CD1 | H15 | 180.0° | 179.9° |
| CZA | CE1 | CD1 | CGA | 1.1° | 0.1° |
| CZA | CE1 | CD1 | H14 | 178.9° | 180.0° |
| CE1 | CZA | OHA | H16 | 0.4° | 89.8° |
| CE1 | CZA | CE2 | H17 | 179.3° | 180.0° |
| CE2 | CD2 | CGA | H18 | 180.0° | 179.5° |
| CE2 | CD2 | CGA | CD1 | 2.3° | 0.5° |
| CE2 | CD2 | CGA | CBA | 180.0° | 179.8° |
| OH4 | CE4 | CZB | OHB | 4.5° | 0.0° |
| OH4 | CE4 | CZB | CD4 | 177.1° | 180.0° |
| OH4 | CE4 | CZB | CE3 | 174.9° | 180.0° |
| OH4 | CE4 | CD4 | CGB | 178.1° | 180.0° |
| OH4 | CE4 | CD4 | H4 | 2.0° | 0.1° |
| OHB | CZB | CE4 | CE3 | 179.4° | 180.0° |
| OHB | CZB | CE4 | CD4 | 178.4° | 180.0° |
| OHB | CZB | CE3 | CD3 | 178.6° | 179.7° |
| OHB | CZB | CE3 | H7 | 1.3° | 0.0° |
| CE1 | CD1 | CGA | CD2 | 2.1° | 0.2° |
| CE1 | CD1 | CGA | H14 | 180.0° | 179.9° |
| CE1 | CD1 | CGA | CBA | 179.8° | 179.9° |
| CE4 | CZB | CE3 | CD3 | 1.9° | 0.3° |
| CZB | CE4 | CD4 | CGB | 1.0° | 0.0° |
| CZB | CE4 | CD4 | H4 | 179.0° | 180.0° |
| CZB | CE4 | OH4 | H5 | 180.0° | 90.0° |
| CE4 | CZB | OHB | H6 | 180.0° | 90.0° |
| CE4 | CZB | CE3 | H7 | 178.1° | 180.0° |
| CE3 | CZB | CE4 | CD4 | 2.2° | 0.0° |
| CZB | CE3 | CD3 | H7 | 180.0° | 179.7° |
| CZB | CE3 | CD3 | CGB | 1.6° | 0.5° |
| CE3 | CZB | OHB | H6 | 0.6° | 90.0° |
| CZB | CE3 | CD3 | H8 | 178.4° | 180.0° |
| CE4 | CD4 | CGB | H4 | 180.0° | 180.0° |
| CE4 | CD4 | CGB | CD3 | 4.6° | 0.2° |
| CE4 | CD4 | CGB | CBB | 176.7° | 180.0° |
| CD4 | CE4 | OH4 | H5 | 2.8° | 89.9° |
| CE3 | CD3 | CGB | CD4 | 4.9° | 0.5° |
| CE3 | CD3 | CGB | H8 | 180.0° | 179.5° |
| CE3 | CD3 | CGB | CBB | 176.4° | 179.7° |
| CD4 | CGB | CD3 | CBB | 178.7° | 179.8° |
| CD4 | CGB | CBB | CAB | 91.7° | 90.0° |
| CD4 | CGB | CBB | H2 | 148.6° | 30.0° |
| CD4 | CGB | CBB | H3 | 27.9° | 150.0° |
| CD4 | CGB | CD3 | H8 | 175.1° | 180.0° |
| CD3 | CGB | CBB | CAB | 89.6° | 90.2° |
| CD3 | CGB | CBB | H2 | 30.1° | 149.8° |
| CD3 | CGB | CBB | H3 | 150.8° | 29.8° |
| CD3 | CGB | CD4 | H4 | 175.4° | 179.8° |
| CGB | CD3 | CE3 | H7 | 178.4° | 179.8° |
| CGB | CBB | CAB | H2 | 119.6° | 120.0° |
| CGB | CBB | CAB | H3 | 119.7° | 120.0° |
| CGB | CBB | CAB | NB | 67.8° | 65.0° |
| CGB | CBB | CAB | CB | 166.8° | 173.2° |
| CGB | CBB | CAB | H1 | 49.5° | 54.1° |
| CGB | CBB | H2 | H3 | 121.1° | 120.0° |
| CBB | CGB | CD4 | H4 | 3.3° | 0.0° |
| CBB | CGB | CD3 | H8 | 3.6° | 0.2° |
| CD2 | CGA | CD1 | CBA | 177.7° | 179.7° |
| CD2 | CGA | CBA | CAA | 92.3° | 90.3° |
| CD2 | CGA | CBA | H12 | 147.3° | 149.8° |
| CD2 | CGA | CBA | H13 | 28.2° | 29.7° |
| CD2 | CGA | CD1 | H14 | 177.9° | 179.7° |
| CGA | CD2 | CE2 | H17 | 178.3° | 179.7° |
| CD1 | CGA | CBA | CAA | 85.3° | 90.0° |
| CD1 | CGA | CBA | H12 | 35.1° | 29.9° |
| CD1 | CGA | CBA | H13 | 154.2° | 150.0° |
| CGA | CD1 | CE1 | H15 | 178.9° | 179.9° |
| CD1 | CGA | CD2 | H18 | 177.7° | 179.9° |
| CBB | CAB | NB | CB | 122.3° | 120.4° |
| CBB | CAB | NB | H1 | 116.2° | 119.1° |
| CBB | CAB | CB | H1 | 116.7° | 119.0° |
| CBB | CAB | NB | CA | 113.1° | 101.0° |
| CBB | CAB | CB | OB | 68.1° | 79.3° |
| CBB | CAB | CB | NA | 113.7° | 101.1° |
| CAB | CBB | H2 | H3 | 121.0° | 120.0° |
| CBB | CAB | NB | H9 | 66.9° | 78.9° |
| CGA | CBA | CAA | H12 | 120.4° | 119.9° |
| CGA | CBA | CAA | H13 | 120.4° | 120.1° |
| CGA | CBA | CAA | CA | 62.8° | 175.0° |
| CGA | CBA | CAA | NA | 62.8° | 63.1° |
| CGA | CBA | CAA | H11 | 179.0° | 56.0° |
| CGA | CBA | H12 | H13 | 118.7° | 120.1° |
| CBA | CGA | CD1 | H14 | 0.2° | 0.0° |
| CBA | CGA | CD2 | H18 | 0.0° | 0.2° |
| NB | CAB | CB | H1 | 121.8° | 120.5° |
| CAB | NB | CA | H9 | 180.0° | 179.9° |
| NB | CAB | CB | OB | 170.4° | 160.2° |
| NB | CAB | CB | NA | 7.8° | 19.4° |
| CAB | NB | CA | OA | 179.7° | 180.0° |
| CAB | NB | CA | CAA | 1.2° | 0.1° |
| NB | CAB | CBB | H2 | 172.6° | 55.0° |
| NB | CAB | CBB | H3 | 51.9° | 175.0° |
| CB | CAB | NB | CA | 9.2° | 19.5° |
| CAB | CB | OB | NA | 178.2° | 179.7° |
| CAB | CB | NA | CAA | 1.2° | 0.6° |
| CB | CAB | CBB | H2 | 47.2° | 66.8° |
| CB | CAB | CBB | H3 | 73.5° | 53.2° |
| CB | CAB | NB | H9 | 170.8° | 160.6° |
| CAB | CB | NA | H10 | 178.8° | 179.6° |
| NB | CA | CAA | CBA | 116.5° | 100.8° |
| NB | CA | OA | CAA | 179.0° | 179.9° |
| NB | CA | CAA | NA | 7.6° | 19.9° |
| CA | NB | CAB | H1 | 130.7° | 140.0° |
| NB | CA | CAA | H11 | 127.2° | 140.2° |
| OB | CB | NA | CAA | 179.4° | 179.7° |
| OB | CB | CAB | H1 | 48.6° | 39.7° |
| OB | CB | NA | H10 | 0.6° | 0.0° |
| CBA | CAA | NA | CB | 114.1° | 100.6° |
| CBA | CAA | CA | OA | 64.4° | 79.2° |
| CBA | CAA | CA | NA | 124.1° | 120.7° |
| CBA | CAA | CA | H11 | 116.3° | 119.0° |
| CBA | CAA | NA | H11 | 117.7° | 119.1° |
| CBA | CAA | NA | H10 | 65.9° | 79.1° |
| CAA | CBA | H12 | H13 | 118.7° | 120.0° |
| CB | NA | CAA | CA | 9.1° | 19.9° |
| CB | NA | CAA | H10 | 180.0° | 179.7° |
| NA | CB | CAB | H1 | 129.6° | 139.9° |
| CB | NA | CAA | H11 | 128.2° | 140.3° |
| OA | CA | CAA | NA | 171.5° | 160.1° |
| OA | CA | NB | H9 | 0.3° | 0.1° |
| OA | CA | CAA | H11 | 51.9° | 39.8° |
| CA | CAA | NA | H11 | 119.1° | 120.3° |
| CAA | CA | NB | H9 | 178.8° | 180.0° |
| CA | CAA | NA | H10 | 170.9° | 160.3° |
| CA | CAA | CBA | H12 | 176.8° | 65.1° |
| CA | CAA | CBA | H13 | 57.7° | 54.9° |
| NA | CAA | CBA | H12 | 57.6° | 56.8° |
| NA | CAA | CBA | H13 | 176.7° | 176.8° |
| H1 | CAB | CBB | H2 | 70.1° | 174.1° |
| H1 | CAB | CBB | H3 | 169.2° | 65.9° |
| H1 | CAB | NB | H9 | 49.3° | 40.2° |
| H7 | CE3 | CD3 | H8 | 1.6° | 0.2° |
| H10 | NA | CAA | H11 | 51.8° | 40.0° |
| H11 | CAA | CBA | H12 | 60.5° | 175.9° |
| H11 | CAA | CBA | H13 | 58.6° | 64.1° |
| H14 | CD1 | CE1 | H15 | 1.1° | 0.1° |
| H17 | CE2 | CD2 | H18 | 1.7° | 0.2° |
