QRT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N10 | C1 | sing | 1.35Å | 1.31Å | |
| O11 | C1 | doub | 1.22Å | 1.23Å | |
| C1 | C6 | sing | 1.48Å | 1.46Å | |
| C5 | C6 | doub | 1.36Å | 1.38Å | |
| C5 | C4 | sing | 1.47Å | 1.38Å | |
| C6 | N1 | sing | 1.38Å | 1.42Å | |
| O4 | C4 | doub | 1.22Å | 1.27Å | |
| C4 | N3 | sing | 1.35Å | 1.36Å | |
| N1 | C1' | sing | 1.46Å | 1.48Å | |
| N1 | C2 | sing | 1.34Å | 1.37Å | |
| C1' | O4' | sing | 1.44Å | 1.45Å | |
| C1' | C2' | sing | 1.54Å | 1.52Å | |
| O4' | C4' | sing | 1.44Å | 1.43Å | |
| N3 | C2 | sing | 1.34Å | 1.33Å | |
| O2' | C2' | sing | 1.43Å | 1.43Å | |
| C2 | O2 | doub | 1.22Å | 1.24Å | |
| O3' | C3' | sing | 1.43Å | 1.45Å | |
| C2' | C3' | sing | 1.54Å | 1.51Å | |
| C4' | C3' | sing | 1.55Å | 1.51Å | |
| C4' | C5' | sing | 1.53Å | 1.52Å | |
| C5' | O5' | sing | 1.43Å | 1.41Å | |
| O5' | P | sing | 1.61Å | 1.61Å | |
| O2P | P | doub | 1.48Å | 1.52Å | |
| P | O3P | sing | 1.61Å | 1.51Å | |
| P | O1P | sing | 1.61Å | 1.51Å | |
| O1P | H1 | sing | 0.97Å | 0.95Å | |
| O3P | H2 | sing | 0.97Å | 0.95Å | |
| C5' | H3 | sing | 1.09Å | 1.10Å | |
| C5' | H4 | sing | 1.09Å | 1.10Å | |
| C4' | H5 | sing | 1.09Å | 1.10Å | |
| C1' | H6 | sing | 1.09Å | 1.10Å | |
| N3 | H7 | sing | 0.97Å | 1.00Å | |
| C5 | H8 | sing | 1.08Å | 1.08Å | |
| C2' | H9 | sing | 1.09Å | 1.10Å | |
| C3' | H10 | sing | 1.09Å | 1.10Å | |
| O3' | H11 | sing | 0.97Å | 0.95Å | |
| O2' | H12 | sing | 0.97Å | 0.95Å | |
| N10 | H13 | sing | 0.97Å | 1.00Å | |
| N10 | H14 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N10 | C1 | O11 | 125.6° | 120.0° |
| N10 | C1 | C6 | 113.9° | 120.1° |
| C1 | N10 | H13 | 120.0° | 120.0° |
| C1 | N10 | H14 | 120.0° | 120.0° |
| O11 | C1 | C6 | 120.4° | 119.9° |
| C1 | C6 | C5 | 118.9° | 120.3° |
| C1 | C6 | N1 | 118.6° | 120.2° |
| C6 | C5 | C4 | 117.7° | 118.4° |
| C5 | C6 | N1 | 121.5° | 119.5° |
| C6 | C5 | H8 | 121.1° | 120.8° |
| C5 | C4 | O4 | 122.5° | 120.6° |
| C5 | C4 | N3 | 119.7° | 118.8° |
| C4 | C5 | H8 | 121.1° | 120.8° |
| C6 | N1 | C1' | 119.9° | 119.5° |
| C6 | N1 | C2 | 117.7° | 121.1° |
| O4 | C4 | N3 | 117.7° | 120.6° |
| C4 | N3 | C2 | 123.8° | 120.4° |
| C4 | N3 | H7 | 118.1° | 119.8° |
| C1' | N1 | C2 | 122.3° | 119.4° |
| N1 | C1' | O4' | 108.9° | 110.4° |
| N1 | C1' | C2' | 117.1° | 110.4° |
| N1 | C1' | H6 | 108.5° | 110.4° |
| N1 | C2 | N3 | 119.5° | 121.8° |
| N1 | C2 | O2 | 120.1° | 119.1° |
| O4' | C1' | C2' | 105.2° | 104.8° |
| C1' | O4' | C4' | 110.4° | 105.3° |
| O4' | C1' | H6 | 108.9° | 110.3° |
| C1' | C2' | O2' | 111.1° | 110.5° |
| C1' | C2' | C3' | 104.2° | 104.1° |
| C2' | C1' | H6 | 108.0° | 110.4° |
| C1' | C2' | H9 | 110.0° | 110.5° |
| O4' | C4' | C3' | 106.5° | 104.8° |
| O4' | C4' | C5' | 109.5° | 110.4° |
| O4' | C4' | H5 | 109.4° | 110.5° |
| N3 | C2 | O2 | 120.0° | 119.1° |
| C2 | N3 | H7 | 118.1° | 119.8° |
| O2' | C2' | C3' | 109.9° | 110.5° |
| O2' | C2' | H9 | 111.3° | 110.5° |
| C2' | O2' | H12 | 109.5° | 114.0° |
| O3' | C3' | C2' | 111.8° | 110.5° |
| O3' | C3' | C4' | 111.4° | 110.5° |
| O3' | C3' | H10 | 110.6° | 110.6° |
| C3' | O3' | H11 | 109.5° | 114.0° |
| C2' | C3' | C4' | 103.1° | 104.0° |
| C3' | C2' | H9 | 110.1° | 110.5° |
| C2' | C3' | H10 | 109.9° | 110.6° |
| C3' | C4' | C5' | 114.7° | 110.3° |
| C3' | C4' | H5 | 108.4° | 110.4° |
| C4' | C3' | H10 | 109.8° | 110.5° |
| C4' | C5' | O5' | 105.9° | 109.5° |
| C4' | C5' | H3 | 110.4° | 109.5° |
| C4' | C5' | H4 | 110.4° | 109.5° |
| C5' | C4' | H5 | 108.3° | 110.3° |
| C5' | O5' | P | 120.4° | 123.0° |
| O5' | C5' | H3 | 110.3° | 109.5° |
| O5' | C5' | H4 | 110.3° | 109.4° |
| O5' | P | O2P | 106.3° | 109.4° |
| O5' | P | O3P | 109.8° | 109.5° |
| O5' | P | O1P | 101.9° | 109.5° |
| O2P | P | O3P | 112.8° | 109.5° |
| O2P | P | O1P | 111.3° | 109.4° |
| O3P | P | O1P | 113.9° | 109.5° |
| P | O3P | H2 | 109.5° | 114.0° |
| P | O1P | H1 | 109.5° | 114.0° |
| H3 | C5' | H4 | 109.5° | 109.4° |
| H13 | N10 | H14 | 120.0° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N10 | C1 | O11 | C6 | 175.2° | 180.0° |
| N10 | C1 | C6 | C5 | 67.7° | 85.3° |
| N10 | C1 | C6 | N1 | 123.9° | 94.6° |
| C1 | N10 | H13 | H14 | 180.0° | 179.9° |
| O11 | C1 | C6 | C5 | 108.1° | 94.7° |
| O11 | C1 | C6 | N1 | 60.3° | 85.4° |
| O11 | C1 | N10 | H13 | 0.0° | 179.9° |
| O11 | C1 | N10 | H14 | 180.0° | 0.0° |
| C1 | C6 | C5 | N1 | 168.1° | 179.9° |
| C1 | C6 | C5 | C4 | 166.6° | 180.0° |
| C1 | C6 | N1 | C1' | 17.2° | 0.0° |
| C1 | C6 | N1 | C2 | 167.1° | 179.9° |
| C1 | C6 | C5 | H8 | 13.4° | 0.1° |
| C6 | C1 | N10 | H13 | 175.5° | 0.1° |
| C6 | C1 | N10 | H14 | 4.5° | 180.0° |
| C6 | C5 | C4 | H8 | 180.0° | 180.0° |
| C6 | C5 | C4 | O4 | 175.4° | 179.7° |
| C6 | C5 | C4 | N3 | 0.5° | 0.1° |
| C5 | C6 | N1 | C1' | 174.7° | 180.0° |
| C5 | C6 | N1 | C2 | 1.0° | 0.0° |
| C4 | C5 | C6 | N1 | 1.5° | 0.0° |
| C5 | C4 | O4 | N3 | 175.0° | 179.7° |
| C5 | C4 | N3 | C2 | 3.1° | 0.1° |
| C5 | C4 | N3 | H7 | 176.9° | 180.0° |
| C6 | N1 | C1' | C2 | 175.5° | 180.0° |
| C6 | N1 | C1' | O4' | 118.4° | 128.5° |
| C6 | N1 | C1' | C2' | 122.5° | 116.1° |
| C6 | N1 | C2 | N3 | 1.5° | 0.0° |
| C6 | N1 | C2 | O2 | 174.6° | 180.0° |
| C6 | N1 | C1' | H6 | 0.0° | 6.3° |
| N1 | C6 | C5 | H8 | 178.5° | 180.0° |
| O4 | C4 | N3 | C2 | 178.3° | 179.7° |
| O4 | C4 | N3 | H7 | 1.7° | 0.4° |
| O4 | C4 | C5 | H8 | 4.6° | 0.3° |
| C4 | N3 | C2 | N1 | 3.7° | 0.0° |
| C4 | N3 | C2 | H7 | 180.0° | 179.9° |
| C4 | N3 | C2 | O2 | 176.8° | 179.9° |
| N3 | C4 | C5 | H8 | 179.5° | 180.0° |
| N1 | C1' | O4' | C2' | 126.3° | 118.9° |
| N1 | C1' | O4' | H6 | 118.1° | 122.3° |
| N1 | C1' | C2' | H6 | 122.7° | 122.4° |
| N1 | C1' | O4' | C4' | 135.9° | 159.4° |
| C1' | N1 | C2 | N3 | 177.1° | 180.0° |
| N1 | C1' | C2' | O2' | 94.1° | 98.5° |
| C1' | N1 | C2 | O2 | 9.8° | 0.1° |
| N1 | C1' | C2' | C3' | 147.6° | 142.8° |
| N1 | C1' | C2' | H9 | 29.6° | 24.2° |
| C2 | N1 | C1' | O4' | 66.1° | 51.4° |
| C2 | N1 | C1' | C2' | 53.0° | 64.0° |
| N1 | C2 | N3 | O2 | 173.1° | 179.9° |
| C2 | N1 | C1' | H6 | 175.5° | 173.7° |
| N1 | C2 | N3 | H7 | 176.4° | 179.9° |
| O4' | C1' | C2' | H6 | 116.2° | 118.8° |
| O4' | C1' | C2' | O2' | 144.8° | 142.6° |
| O4' | C1' | C2' | C3' | 26.5° | 23.9° |
| C1' | O4' | C4' | C3' | 11.2° | 40.5° |
| C1' | O4' | C4' | C5' | 113.3° | 159.3° |
| C1' | O4' | C4' | H5 | 128.2° | 78.4° |
| O4' | C1' | C2' | H9 | 91.5° | 94.7° |
| C2' | C1' | O4' | C4' | 9.6° | 40.5° |
| C1' | C2' | O2' | C3' | 114.8° | 114.7° |
| C1' | C2' | O2' | H9 | 122.9° | 122.7° |
| C1' | C2' | C3' | O3' | 87.2° | 118.6° |
| C1' | C2' | C3' | H9 | 117.9° | 118.7° |
| C1' | C2' | C3' | C4' | 32.6° | 0.0° |
| C1' | C2' | C3' | H10 | 149.6° | 118.6° |
| C1' | C2' | O2' | H12 | 180.0° | 180.0° |
| O4' | C4' | C3' | O3' | 92.7° | 142.6° |
| O4' | C4' | C3' | C2' | 27.4° | 24.0° |
| O4' | C4' | C3' | C5' | 121.2° | 118.9° |
| O4' | C4' | C3' | H5 | 117.7° | 118.9° |
| O4' | C4' | C5' | H5 | 119.2° | 122.4° |
| O4' | C4' | C5' | O5' | 171.9° | 69.6° |
| O4' | C4' | C5' | H3 | 68.7° | 50.4° |
| O4' | C4' | C5' | H4 | 52.5° | 170.4° |
| C4' | O4' | C1' | H6 | 105.9° | 78.4° |
| O4' | C4' | C3' | H10 | 144.4° | 94.7° |
| O2' | C2' | C3' | O3' | 32.0° | 0.0° |
| O2' | C2' | C3' | H9 | 123.0° | 122.7° |
| O2' | C2' | C3' | C4' | 151.8° | 118.7° |
| O2' | C2' | C1' | H6 | 28.6° | 23.9° |
| O2' | C2' | C3' | H10 | 91.3° | 122.7° |
| O2 | C2 | N3 | H7 | 3.2° | 0.0° |
| O3' | C3' | C2' | C4' | 119.8° | 118.6° |
| O3' | C3' | C2' | H10 | 123.2° | 122.7° |
| O3' | C3' | C4' | H10 | 122.9° | 122.7° |
| O3' | C3' | C4' | C5' | 146.1° | 98.5° |
| O3' | C3' | C4' | H5 | 25.0° | 23.7° |
| O3' | C3' | C2' | H9 | 155.0° | 122.7° |
| C2' | C3' | C4' | H10 | 117.0° | 118.7° |
| C2' | C3' | C4' | C5' | 93.9° | 142.8° |
| C2' | C3' | C4' | H5 | 145.0° | 95.0° |
| C3' | C2' | C1' | H6 | 89.7° | 94.8° |
| C2' | C3' | O3' | H11 | 180.0° | 65.4° |
| C3' | C2' | O2' | H12 | 65.3° | 65.3° |
| C3' | C4' | C5' | H5 | 121.2° | 122.2° |
| C3' | C4' | C5' | O5' | 68.5° | 175.0° |
| C3' | C4' | C5' | H3 | 50.9° | 65.0° |
| C3' | C4' | C5' | H4 | 172.1° | 55.0° |
| C4' | C3' | C2' | H9 | 85.2° | 118.7° |
| C4' | C3' | O3' | H11 | 65.3° | 180.0° |
| C4' | C5' | O5' | H3 | 119.5° | 120.0° |
| C4' | C5' | O5' | H4 | 119.4° | 120.1° |
| C4' | C5' | O5' | P | 175.0° | 180.0° |
| C4' | C5' | H3 | H4 | 121.7° | 120.0° |
| C5' | C4' | C3' | H10 | 23.2° | 24.2° |
| C5' | O5' | P | O2P | 71.9° | 55.0° |
| C5' | O5' | P | O3P | 50.4° | 175.0° |
| C5' | O5' | P | O1P | 171.5° | 65.0° |
| O5' | C5' | H3 | H4 | 121.6° | 119.9° |
| O5' | C5' | C4' | H5 | 52.7° | 52.8° |
| O5' | P | O2P | O3P | 120.4° | 120.0° |
| O5' | P | O2P | O1P | 110.1° | 119.9° |
| O5' | P | O3P | O1P | 113.5° | 120.0° |
| O5' | P | O1P | H1 | 112.9° | 60.1° |
| O5' | P | O3P | H2 | 118.4° | 180.0° |
| P | O5' | C5' | H3 | 65.5° | 60.0° |
| P | O5' | C5' | H4 | 55.6° | 60.0° |
| O2P | P | O3P | O1P | 128.1° | 120.0° |
| O2P | P | O1P | H1 | 0.0° | 180.0° |
| O2P | P | O3P | H2 | 0.0° | 60.0° |
| O3P | P | O1P | H1 | 128.9° | 59.9° |
| O1P | P | O3P | H2 | 128.1° | 60.0° |
| H3 | C5' | C4' | H5 | 172.1° | 172.8° |
| H4 | C5' | C4' | H5 | 66.7° | 67.2° |
| H5 | C4' | C3' | H10 | 97.9° | 146.4° |
| H6 | C1' | C2' | H9 | 152.3° | 146.5° |
| H9 | C2' | C3' | H10 | 31.7° | 0.0° |
| H9 | C2' | O2' | H12 | 57.0° | 57.4° |
| H10 | C3' | O3' | H11 | 57.2° | 57.4° |
