05L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | SE | sing | 1.96Å | 1.97Å | |
| C1' | SE | sing | 1.96Å | 1.96Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C1 | O5 | sing | 1.43Å | 1.41Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| O2 | C2 | sing | 1.43Å | 1.42Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| C3 | O3 | sing | 1.43Å | 1.41Å | |
| C3 | C4 | sing | 1.53Å | 1.54Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C5 | C4 | sing | 1.53Å | 1.54Å | |
| O4 | C4 | sing | 1.43Å | 1.41Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| C5 | O5 | sing | 1.43Å | 1.44Å | |
| C5 | C6 | sing | 1.53Å | 1.53Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | O6 | sing | 1.43Å | 1.42Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å | |
| C1' | C2' | sing | 1.53Å | 1.49Å | |
| C1' | H1' | sing | 1.09Å | 1.10Å | |
| C1' | H1'A | sing | 1.09Å | 1.10Å | |
| C2' | C3' | sing | 1.53Å | 1.51Å | |
| C2' | H2' | sing | 1.09Å | 1.10Å | |
| C2' | H2'A | sing | 1.09Å | 1.10Å | |
| C3' | C4' | sing | 1.53Å | 1.51Å | |
| C3' | H3' | sing | 1.09Å | 1.10Å | |
| C3' | H3'A | sing | 1.09Å | 1.10Å | |
| C4' | C5' | sing | 1.53Å | 1.51Å | |
| C4' | H4' | sing | 1.09Å | 1.10Å | |
| C4' | H4'A | sing | 1.09Å | 1.10Å | |
| C5' | C6' | sing | 1.53Å | 1.52Å | |
| C5' | H5' | sing | 1.09Å | 1.10Å | |
| C5' | H5'A | sing | 1.09Å | 1.10Å | |
| C6' | C7' | sing | 1.53Å | 1.50Å | |
| C6' | H6' | sing | 1.09Å | 1.10Å | |
| C6' | H6'A | sing | 1.09Å | 1.10Å | |
| C7' | H7' | sing | 1.09Å | 1.10Å | |
| C7' | H7'A | sing | 1.09Å | 1.10Å | |
| C7' | H7'B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | SE | C1' | 100.1° | 101.0° |
| SE | C1 | C2 | 103.0° | 109.5° |
| SE | C1 | O5 | 105.8° | 109.5° |
| SE | C1 | H1 | 106.1° | 109.5° |
| SE | C1' | C2' | 103.5° | 109.4° |
| SE | C1' | H1' | 110.9° | 109.5° |
| SE | C1' | H1'A | 110.9° | 109.4° |
| C2 | C1 | O5 | 117.0° | 109.4° |
| C2 | C1 | H1 | 111.0° | 109.5° |
| C1 | C2 | O2 | 107.6° | 109.5° |
| C1 | C2 | C3 | 108.2° | 109.2° |
| C1 | C2 | H2 | 110.6° | 109.5° |
| O5 | C1 | H1 | 112.7° | 109.5° |
| C1 | O5 | C5 | 114.6° | 114.1° |
| O2 | C2 | C3 | 107.7° | 109.5° |
| O2 | C2 | H2 | 112.2° | 109.5° |
| C2 | O2 | HO2 | 109.5° | 114.0° |
| C3 | C2 | H2 | 110.4° | 109.6° |
| C2 | C3 | O3 | 110.1° | 109.5° |
| C2 | C3 | C4 | 106.7° | 109.0° |
| C2 | C3 | H3 | 109.7° | 109.6° |
| O3 | C3 | C4 | 109.0° | 109.5° |
| O3 | C3 | H3 | 111.5° | 109.6° |
| C3 | O3 | HO3 | 109.5° | 114.0° |
| C4 | C3 | H3 | 109.7° | 109.6° |
| C3 | C4 | C5 | 107.0° | 109.1° |
| C3 | C4 | O4 | 110.3° | 109.5° |
| C3 | C4 | H4 | 109.1° | 109.5° |
| C5 | C4 | O4 | 110.4° | 109.6° |
| C5 | C4 | H4 | 109.1° | 109.5° |
| C4 | C5 | O5 | 108.4° | 109.4° |
| C4 | C5 | C6 | 111.7° | 109.5° |
| C4 | C5 | H5 | 109.4° | 109.4° |
| O4 | C4 | H4 | 110.8° | 109.5° |
| C4 | O4 | HO4 | 109.5° | 114.0° |
| O5 | C5 | C6 | 106.9° | 109.5° |
| O5 | C5 | H5 | 110.8° | 109.5° |
| C6 | C5 | H5 | 109.6° | 109.5° |
| C5 | C6 | O6 | 107.9° | 109.5° |
| C5 | C6 | H61 | 109.9° | 109.5° |
| C5 | C6 | H62 | 109.9° | 109.5° |
| O6 | C6 | H61 | 109.8° | 109.4° |
| O6 | C6 | H62 | 109.9° | 109.5° |
| C6 | O6 | HO6 | 109.5° | 114.0° |
| H61 | C6 | H62 | 109.5° | 109.4° |
| C2' | C1' | H1' | 110.9° | 109.5° |
| C2' | C1' | H1'A | 110.9° | 109.5° |
| C1' | C2' | C3' | 108.4° | 109.4° |
| C1' | C2' | H2' | 109.7° | 109.5° |
| C1' | C2' | H2'A | 109.7° | 109.5° |
| H1' | C1' | H1'A | 109.5° | 109.5° |
| C3' | C2' | H2' | 109.7° | 109.5° |
| C3' | C2' | H2'A | 109.7° | 109.4° |
| C2' | C3' | C4' | 109.7° | 109.5° |
| C2' | C3' | H3' | 109.4° | 109.5° |
| C2' | C3' | H3'A | 109.4° | 109.5° |
| H2' | C2' | H2'A | 109.5° | 109.5° |
| C4' | C3' | H3' | 109.4° | 109.4° |
| C4' | C3' | H3'A | 109.4° | 109.5° |
| C3' | C4' | C5' | 107.9° | 109.5° |
| C3' | C4' | H4' | 109.9° | 109.4° |
| C3' | C4' | H4'A | 109.9° | 109.5° |
| H3' | C3' | H3'A | 109.5° | 109.5° |
| C5' | C4' | H4' | 109.9° | 109.5° |
| C5' | C4' | H4'A | 109.9° | 109.5° |
| C4' | C5' | C6' | 109.0° | 109.4° |
| C4' | C5' | H5' | 109.6° | 109.5° |
| C4' | C5' | H5'A | 109.6° | 109.4° |
| H4' | C4' | H4'A | 109.5° | 109.5° |
| C6' | C5' | H5' | 109.6° | 109.5° |
| C6' | C5' | H5'A | 109.6° | 109.5° |
| C5' | C6' | C7' | 107.5° | 109.4° |
| C5' | C6' | H6' | 109.9° | 109.5° |
| C5' | C6' | H6'A | 109.9° | 109.5° |
| H5' | C5' | H5'A | 109.5° | 109.5° |
| C7' | C6' | H6' | 110.0° | 109.5° |
| C7' | C6' | H6'A | 110.0° | 109.4° |
| C6' | C7' | H7' | 109.5° | 109.5° |
| C6' | C7' | H7'A | 109.5° | 109.5° |
| C6' | C7' | H7'B | 109.5° | 109.5° |
| H6' | C6' | H6'A | 109.5° | 109.5° |
| H7' | C7' | H7'A | 109.4° | 109.4° |
| H7' | C7' | H7'B | 109.5° | 109.5° |
| H7'A | C7' | H7'B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| SE | C1 | C2 | O5 | 115.6° | 120.0° |
| SE | C1 | C2 | H1 | 113.1° | 120.0° |
| SE | C1 | O5 | H1 | 115.5° | 120.0° |
| SE | C1 | C2 | O2 | 79.6° | 62.5° |
| SE | C1 | C2 | C3 | 164.3° | 177.6° |
| SE | C1 | C2 | H2 | 43.2° | 57.7° |
| SE | C1 | O5 | C5 | 163.1° | 178.9° |
| C1 | SE | C1' | C2' | 131.7° | 180.0° |
| C1 | SE | C1' | H1' | 109.3° | 60.0° |
| C1 | SE | C1' | H1'A | 12.6° | 60.0° |
| C1' | SE | C1 | C2 | 139.9° | 180.0° |
| C1' | SE | C1 | O5 | 96.7° | 60.1° |
| C1' | SE | C1 | H1 | 23.3° | 60.0° |
| SE | C1' | C2' | H1' | 119.1° | 120.0° |
| SE | C1' | C2' | H1'A | 119.1° | 119.9° |
| SE | C1' | H1' | H1'A | 122.8° | 120.0° |
| SE | C1' | C2' | C3' | 109.8° | 180.0° |
| SE | C1' | C2' | H2' | 130.3° | 60.0° |
| SE | C1' | C2' | H2'A | 10.0° | 60.1° |
| C2 | C1 | O5 | H1 | 130.5° | 120.0° |
| C1 | C2 | O2 | C3 | 116.5° | 119.7° |
| C1 | C2 | O2 | H2 | 121.9° | 120.1° |
| C1 | C2 | C3 | H2 | 121.2° | 119.9° |
| C1 | C2 | O2 | HO2 | 180.0° | 60.0° |
| C1 | C2 | C3 | O3 | 174.6° | 176.8° |
| C1 | C2 | C3 | C4 | 56.5° | 57.1° |
| C1 | C2 | C3 | H3 | 62.3° | 62.9° |
| C2 | C1 | O5 | C5 | 49.0° | 61.2° |
| O5 | C1 | C2 | O2 | 164.8° | 177.6° |
| O5 | C1 | C2 | C3 | 48.7° | 57.7° |
| O5 | C1 | C2 | H2 | 72.3° | 62.3° |
| C1 | O5 | C5 | C4 | 55.4° | 61.2° |
| C1 | O5 | C5 | C6 | 175.9° | 178.9° |
| C1 | O5 | C5 | H5 | 64.7° | 58.8° |
| H1 | C1 | C2 | O2 | 33.5° | 57.6° |
| H1 | C1 | C2 | C3 | 82.6° | 62.3° |
| H1 | C1 | C2 | H2 | 156.4° | 177.7° |
| H1 | C1 | O5 | C5 | 81.4° | 58.9° |
| O2 | C2 | C3 | H2 | 122.8° | 120.2° |
| O2 | C2 | C3 | O3 | 69.3° | 63.3° |
| O2 | C2 | C3 | C4 | 172.5° | 176.9° |
| O2 | C2 | C3 | H3 | 53.8° | 57.0° |
| C3 | C2 | O2 | HO2 | 63.5° | 179.7° |
| C2 | C3 | O3 | C4 | 116.7° | 119.5° |
| C2 | C3 | O3 | H3 | 122.0° | 120.3° |
| C2 | C3 | C4 | H3 | 118.8° | 119.9° |
| C2 | C3 | O3 | HO3 | 180.0° | 60.1° |
| C2 | C3 | C4 | C5 | 66.5° | 57.0° |
| C2 | C3 | C4 | O4 | 173.4° | 177.0° |
| C2 | C3 | C4 | H4 | 51.4° | 62.9° |
| H2 | C2 | O2 | HO2 | 58.1° | 60.1° |
| H2 | C2 | C3 | O3 | 53.5° | 56.9° |
| H2 | C2 | C3 | C4 | 64.7° | 62.9° |
| H2 | C2 | C3 | H3 | 176.5° | 177.2° |
| O3 | C3 | C4 | H3 | 122.4° | 120.2° |
| O3 | C3 | C4 | C5 | 174.7° | 176.8° |
| O3 | C3 | C4 | O4 | 54.5° | 63.2° |
| O3 | C3 | C4 | H4 | 67.4° | 56.9° |
| C4 | C3 | O3 | HO3 | 63.3° | 179.6° |
| C3 | C4 | C5 | O4 | 120.1° | 119.9° |
| C3 | C4 | C5 | H4 | 117.9° | 119.9° |
| C3 | C4 | O4 | H4 | 120.9° | 120.1° |
| C3 | C4 | O4 | HO4 | 180.0° | 60.0° |
| C3 | C4 | C5 | O5 | 64.8° | 57.6° |
| C3 | C4 | C5 | C6 | 177.6° | 177.6° |
| C3 | C4 | C5 | H5 | 56.1° | 62.4° |
| H3 | C3 | O3 | HO3 | 58.0° | 60.2° |
| H3 | C3 | C4 | C5 | 52.3° | 62.9° |
| H3 | C3 | C4 | O4 | 67.8° | 57.0° |
| H3 | C3 | C4 | H4 | 170.2° | 177.2° |
| C5 | C4 | O4 | H4 | 121.0° | 120.2° |
| C5 | C4 | O4 | HO4 | 61.9° | 179.7° |
| C4 | C5 | O5 | C6 | 120.5° | 120.0° |
| C4 | C5 | O5 | H5 | 120.1° | 120.0° |
| C4 | C5 | C6 | H5 | 121.4° | 120.0° |
| C4 | C5 | C6 | O6 | 60.8° | 174.9° |
| C4 | C5 | C6 | H61 | 179.5° | 55.0° |
| C4 | C5 | C6 | H62 | 59.0° | 65.0° |
| O4 | C4 | C5 | O5 | 175.1° | 177.5° |
| O4 | C4 | C5 | C6 | 57.6° | 62.5° |
| O4 | C4 | C5 | H5 | 63.9° | 57.5° |
| H4 | C4 | O4 | HO4 | 59.1° | 60.1° |
| H4 | C4 | C5 | O5 | 53.1° | 62.3° |
| H4 | C4 | C5 | C6 | 64.4° | 57.7° |
| H4 | C4 | C5 | H5 | 174.0° | 177.7° |
| O5 | C5 | C6 | H5 | 120.2° | 120.1° |
| O5 | C5 | C6 | O6 | 57.6° | 65.1° |
| O5 | C5 | C6 | H61 | 62.1° | 174.9° |
| O5 | C5 | C6 | H62 | 177.4° | 55.0° |
| C5 | C6 | O6 | H61 | 119.7° | 120.0° |
| C5 | C6 | O6 | H62 | 119.8° | 120.1° |
| C5 | C6 | H61 | H62 | 120.7° | 120.0° |
| C5 | C6 | O6 | HO6 | 180.0° | 179.9° |
| H5 | C5 | C6 | O6 | 177.8° | 55.0° |
| H5 | C5 | C6 | H61 | 58.1° | 65.0° |
| H5 | C5 | C6 | H62 | 62.4° | 175.0° |
| O6 | C6 | H61 | H62 | 120.7° | 120.0° |
| H61 | C6 | O6 | HO6 | 60.3° | 60.1° |
| H62 | C6 | O6 | HO6 | 60.2° | 59.9° |
| C2' | C1' | H1' | H1'A | 122.7° | 120.1° |
| C1' | C2' | C3' | H2' | 119.8° | 120.0° |
| C1' | C2' | C3' | H2'A | 119.9° | 120.0° |
| C1' | C2' | H2' | H2'A | 120.5° | 120.1° |
| C1' | C2' | C3' | C4' | 169.6° | 180.0° |
| C1' | C2' | C3' | H3' | 49.6° | 60.0° |
| C1' | C2' | C3' | H3'A | 70.4° | 60.0° |
| H1' | C1' | C2' | C3' | 9.3° | 60.0° |
| H1' | C1' | C2' | H2' | 110.6° | 180.0° |
| H1' | C1' | C2' | H2'A | 129.1° | 59.9° |
| H1'A | C1' | C2' | C3' | 131.1° | 60.1° |
| H1'A | C1' | C2' | H2' | 11.3° | 59.9° |
| H1'A | C1' | C2' | H2'A | 109.0° | 180.0° |
| C3' | C2' | H2' | H2'A | 120.5° | 120.0° |
| C2' | C3' | C4' | H3' | 120.0° | 120.0° |
| C2' | C3' | C4' | H3'A | 120.0° | 120.0° |
| C2' | C3' | H3' | H3'A | 119.9° | 120.0° |
| C2' | C3' | C4' | C5' | 145.0° | 180.0° |
| C2' | C3' | C4' | H4' | 95.2° | 60.0° |
| C2' | C3' | C4' | H4'A | 25.3° | 60.0° |
| H2' | C2' | C3' | C4' | 70.6° | 60.0° |
| H2' | C2' | C3' | H3' | 169.4° | 180.0° |
| H2' | C2' | C3' | H3'A | 49.5° | 60.0° |
| H2'A | C2' | C3' | C4' | 49.7° | 60.0° |
| H2'A | C2' | C3' | H3' | 70.3° | 60.0° |
| H2'A | C2' | C3' | H3'A | 169.8° | 180.0° |
| C4' | C3' | H3' | H3'A | 119.9° | 120.0° |
| C3' | C4' | C5' | H4' | 119.7° | 120.0° |
| C3' | C4' | C5' | H4'A | 119.8° | 120.0° |
| C3' | C4' | H4' | H4'A | 120.7° | 120.0° |
| C3' | C4' | C5' | C6' | 147.6° | 180.0° |
| C3' | C4' | C5' | H5' | 27.7° | 60.0° |
| C3' | C4' | C5' | H5'A | 92.4° | 60.0° |
| H3' | C3' | C4' | C5' | 25.0° | 60.0° |
| H3' | C3' | C4' | H4' | 144.7° | NaN° |
| H3' | C3' | C4' | H4'A | 94.8° | 60.0° |
| H3'A | C3' | C4' | C5' | 95.0° | 60.0° |
| H3'A | C3' | C4' | H4' | 24.8° | 60.0° |
| H3'A | C3' | C4' | H4'A | 145.3° | 180.0° |
| C5' | C4' | H4' | H4'A | 120.7° | 120.0° |
| C4' | C5' | C6' | H5' | 119.9° | 120.0° |
| C4' | C5' | C6' | H5'A | 119.9° | 119.9° |
| C4' | C5' | H5' | H5'A | 120.2° | 120.0° |
| C4' | C5' | C6' | C7' | 147.4° | 180.0° |
| C4' | C5' | C6' | H6' | 27.7° | 60.0° |
| C4' | C5' | C6' | H6'A | 92.9° | 60.1° |
| H4' | C4' | C5' | C6' | 92.6° | 60.0° |
| H4' | C4' | C5' | H5' | 147.5° | 180.0° |
| H4' | C4' | C5' | H5'A | 27.3° | 60.0° |
| H4'A | C4' | C5' | C6' | 27.9° | 60.0° |
| H4'A | C4' | C5' | H5' | 92.0° | 60.0° |
| H4'A | C4' | C5' | H5'A | 147.8° | 180.0° |
| C6' | C5' | H5' | H5'A | 120.2° | 120.1° |
| C5' | C6' | C7' | H6' | 119.7° | 120.0° |
| C5' | C6' | C7' | H6'A | 119.7° | 120.0° |
| C5' | C6' | H6' | H6'A | 120.9° | 120.1° |
| C5' | C6' | C7' | H7' | 180.0° | 180.0° |
| C5' | C6' | C7' | H7'A | 60.0° | 60.0° |
| C5' | C6' | C7' | H7'B | 60.0° | 60.0° |
| H5' | C5' | C6' | C7' | 92.7° | 60.0° |
| H5' | C5' | C6' | H6' | 147.6° | 180.0° |
| H5' | C5' | C6' | H6'A | 27.0° | 59.9° |
| H5'A | C5' | C6' | C7' | 27.5° | 60.1° |
| H5'A | C5' | C6' | H6' | 92.3° | 59.9° |
| H5'A | C5' | C6' | H6'A | 147.2° | 180.0° |
| C7' | C6' | H6' | H6'A | 120.9° | 120.0° |
| C6' | C7' | H7' | H7'A | 120.0° | 120.0° |
| C6' | C7' | H7' | H7'B | 120.0° | 120.1° |
| C6' | C7' | H7'A | H7'B | 120.0° | 120.0° |
| H6' | C6' | C7' | H7' | 60.3° | 60.0° |
| H6' | C6' | C7' | H7'A | 179.7° | 180.0° |
| H6' | C6' | C7' | H7'B | 59.7° | 60.0° |
| H6'A | C6' | C7' | H7' | 60.3° | 60.0° |
| H6'A | C6' | C7' | H7'A | 59.7° | 60.0° |
| H6'A | C6' | C7' | H7'B | 179.7° | 180.0° |
| H7' | C7' | H7'A | H7'B | 120.0° | 120.0° |






