ASU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| P | OP1 | doub | 1.48Å | 1.48Å | |
| P | OP2 | sing | 1.61Å | 1.48Å | |
| P | OP3 | sing | 1.61Å | 1.61Å | |
| P | O5' | sing | 1.61Å | 1.59Å | |
| OP2 | HOP2 | sing | 0.97Å | 0.95Å | |
| OP3 | HOP3 | sing | 0.97Å | 0.95Å | |
| O5' | C5' | sing | 1.43Å | 1.42Å | |
| S4' | C4' | sing | 1.84Å | 1.82Å | |
| S4' | C1' | sing | 1.84Å | 1.78Å | |
| O1' | C1' | sing | 1.43Å | 1.43Å | |
| O1' | HO'1 | sing | 0.97Å | 0.95Å | |
| C2' | C1' | sing | 1.55Å | 1.53Å | |
| C2' | C3' | sing | 1.54Å | 1.54Å | |
| C2' | H2' | sing | 1.09Å | 1.12Å | |
| C2' | H2'' | sing | 1.09Å | 1.12Å | |
| C5' | C4' | sing | 1.53Å | 1.51Å | |
| C5' | H5' | sing | 1.09Å | 1.12Å | |
| C5' | H5'' | sing | 1.09Å | 1.11Å | |
| C4' | C3' | sing | 1.55Å | 1.54Å | |
| C4' | H4' | sing | 1.09Å | 1.11Å | |
| C1' | H1' | sing | 1.09Å | 1.11Å | |
| C3' | O3' | sing | 1.43Å | 1.43Å | |
| C3' | H3' | sing | 1.09Å | 1.12Å | |
| O3' | HO'3 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OP1 | P | OP2 | 119.7° | 109.5° |
| OP1 | P | OP3 | 108.4° | 109.4° |
| OP1 | P | O5' | 106.4° | 109.4° |
| OP2 | P | OP3 | 107.9° | 109.5° |
| OP2 | P | O5' | 109.0° | 109.5° |
| P | OP2 | HOP2 | 119.8° | 106.8° |
| OP3 | P | O5' | 104.4° | 109.5° |
| P | OP3 | HOP3 | 108.4° | 106.8° |
| P | O5' | C5' | 121.1° | 106.9° |
| O5' | C5' | C4' | 109.8° | 109.5° |
| O5' | C5' | H5' | 112.1° | 109.4° |
| O5' | C5' | H5'' | 112.1° | 109.5° |
| C4' | S4' | C1' | 98.0° | 99.5° |
| S4' | C4' | C5' | 111.5° | 110.9° |
| S4' | C4' | C3' | 105.4° | 102.7° |
| S4' | C4' | H4' | 112.9° | 110.8° |
| S4' | C1' | O1' | 105.8° | 111.2° |
| S4' | C1' | C2' | 103.2° | 100.6° |
| S4' | C1' | H1' | 116.4° | 111.2° |
| C1' | O1' | HO'1 | 105.8° | 106.7° |
| O1' | C1' | C2' | 111.6° | 111.1° |
| O1' | C1' | H1' | 108.6° | 111.1° |
| C1' | C2' | C3' | 108.6° | 108.1° |
| C1' | C2' | H2' | 112.6° | 109.8° |
| C1' | C2' | H2'' | 112.5° | 109.7° |
| C2' | C1' | H1' | 111.0° | 111.2° |
| C3' | C2' | H2' | 112.5° | 109.8° |
| C3' | C2' | H2'' | 112.5° | 109.7° |
| C2' | C3' | C4' | 108.0° | 109.9° |
| C2' | C3' | O3' | 112.7° | 109.4° |
| C2' | C3' | H3' | 108.3° | 109.4° |
| H2' | C2' | H2'' | 97.9° | 109.7° |
| C4' | C5' | H5' | 112.1° | 109.4° |
| C4' | C5' | H5'' | 112.1° | 109.5° |
| C5' | C4' | C3' | 114.7° | 110.8° |
| C5' | C4' | H4' | 103.2° | 110.7° |
| H5' | C5' | H5'' | 98.3° | 109.5° |
| C3' | C4' | H4' | 109.5° | 110.7° |
| C4' | C3' | O3' | 109.4° | 109.4° |
| C4' | C3' | H3' | 111.6° | 109.4° |
| O3' | C3' | H3' | 106.8° | 109.4° |
| C3' | O3' | HO'3 | 112.7° | 106.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OP1 | P | OP2 | OP3 | 124.6° | 120.0° |
| OP1 | P | OP2 | O5' | 122.7° | 120.0° |
| OP1 | P | OP3 | O5' | 113.1° | 119.9° |
| OP1 | P | OP2 | HOP2 | 180.0° | 60.0° |
| OP1 | P | OP3 | HOP3 | 180.0° | 180.0° |
| OP1 | P | O5' | C5' | 179.5° | 59.9° |
| OP2 | P | OP3 | O5' | 115.8° | 120.1° |
| OP2 | P | OP3 | HOP3 | 48.9° | 60.0° |
| OP2 | P | O5' | C5' | 50.2° | 179.9° |
| OP3 | P | OP2 | HOP2 | 55.5° | 59.9° |
| OP3 | P | O5' | C5' | 64.9° | 60.0° |
| O5' | P | OP2 | HOP2 | 57.3° | 180.0° |
| O5' | P | OP3 | HOP3 | 66.9° | 60.0° |
| P | O5' | C5' | C4' | 156.7° | 180.0° |
| P | O5' | C5' | H5' | 78.0° | 60.0° |
| P | O5' | C5' | H5'' | 31.5° | 60.0° |
| O5' | C5' | C4' | S4' | 57.7° | 66.7° |
| O5' | C5' | C4' | H5' | 125.3° | 119.9° |
| O5' | C5' | C4' | H5'' | 125.3° | 120.0° |
| O5' | C5' | H5' | H5'' | 118.0° | 120.0° |
| O5' | C5' | C4' | C3' | 177.3° | 179.9° |
| O5' | C5' | C4' | H4' | 63.7° | 56.7° |
| C4' | S4' | C1' | O1' | 95.3° | 139.3° |
| C4' | S4' | C1' | C2' | 22.1° | 21.6° |
| S4' | C4' | C3' | C2' | 24.5° | 28.1° |
| S4' | C4' | C5' | C3' | 119.6° | 113.3° |
| S4' | C4' | C5' | H4' | 121.4° | 123.4° |
| S4' | C4' | C5' | H5' | 67.6° | 173.4° |
| S4' | C4' | C5' | H5'' | 177.0° | 53.3° |
| S4' | C4' | C3' | H4' | 121.7° | 118.3° |
| C4' | S4' | C1' | H1' | 143.9° | 96.3° |
| S4' | C4' | C3' | O3' | 98.5° | 148.2° |
| S4' | C4' | C3' | H3' | 143.4° | 92.0° |
| S4' | C1' | O1' | C2' | 111.6° | 111.1° |
| S4' | C1' | O1' | H1' | 125.7° | 124.5° |
| S4' | C1' | O1' | HO'1 | 180.0° | 65.1° |
| S4' | C1' | C2' | H1' | 125.4° | 117.8° |
| S4' | C1' | C2' | C3' | 39.8° | 40.7° |
| S4' | C1' | C2' | H2' | 165.1° | 79.0° |
| S4' | C1' | C2' | H2'' | 85.4° | 160.4° |
| C1' | S4' | C4' | C5' | 123.8° | 121.3° |
| C1' | S4' | C4' | C3' | 1.2° | 3.0° |
| C1' | S4' | C4' | H4' | 120.7° | 115.3° |
| O1' | C1' | C2' | H1' | 121.4° | 124.3° |
| O1' | C1' | C2' | C3' | 73.4° | 158.6° |
| O1' | C1' | C2' | H2' | 51.9° | 38.8° |
| O1' | C1' | C2' | H2'' | 161.4° | 81.8° |
| HO'1 | O1' | C1' | C2' | 68.4° | 176.3° |
| HO'1 | O1' | C1' | H1' | 54.3° | 59.4° |
| C1' | C2' | C3' | H2' | 125.3° | 119.8° |
| C1' | C2' | C3' | H2'' | 125.3° | 119.6° |
| C1' | C2' | H2' | H2'' | 118.5° | 120.6° |
| C1' | C2' | C3' | C4' | 43.0° | 47.6° |
| C1' | C2' | C3' | O3' | 78.0° | 167.7° |
| C1' | C2' | C3' | H3' | 164.0° | 72.5° |
| C3' | C2' | H2' | H2'' | 118.4° | 120.6° |
| C2' | C3' | C4' | C5' | 98.4° | 146.6° |
| C2' | C3' | C4' | O3' | 123.0° | 120.1° |
| C2' | C3' | C4' | H3' | 118.9° | 120.1° |
| C2' | C3' | C4' | H4' | 146.2° | 90.2° |
| C3' | C2' | C1' | H1' | 165.3° | 77.1° |
| C2' | C3' | O3' | H3' | 118.8° | 119.8° |
| C2' | C3' | O3' | HO'3 | 180.0° | 61.4° |
| H2' | C2' | C3' | C4' | 168.3° | 72.2° |
| H2' | C2' | C1' | H1' | 69.4° | 163.1° |
| H2' | C2' | C3' | O3' | 47.3° | 47.9° |
| H2' | C2' | C3' | H3' | 70.7° | 167.7° |
| H2'' | C2' | C3' | C4' | 82.3° | 167.2° |
| H2'' | C2' | C1' | H1' | 40.0° | 42.5° |
| H2'' | C2' | C3' | O3' | 156.7° | 72.7° |
| H2'' | C2' | C3' | H3' | 38.8° | 47.1° |
| C4' | C5' | H5' | H5'' | 118.0° | 120.0° |
| C5' | C4' | C3' | H4' | 115.4° | 123.2° |
| C5' | C4' | C3' | O3' | 138.5° | 93.3° |
| C5' | C4' | C3' | H3' | 20.5° | 26.5° |
| H5' | C5' | C4' | C3' | 52.0° | 60.0° |
| H5' | C5' | C4' | H4' | 171.0° | 63.2° |
| H5'' | C5' | C4' | C3' | 57.4° | 60.0° |
| H5'' | C5' | C4' | H4' | 61.6° | 176.7° |
| C4' | C3' | O3' | H3' | 121.0° | 119.8° |
| C4' | C3' | O3' | HO'3 | 59.8° | 178.1° |
| H4' | C4' | C3' | O3' | 23.2° | 29.9° |
| H4' | C4' | C3' | H3' | 94.9° | 149.7° |
| H3' | C3' | O3' | HO'3 | 61.2° | 58.4° |
