8QR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N07 | C06 | sing | 1.47Å | 1.43Å | |
| C06 | C05 | sing | 1.55Å | 1.54Å | |
| C06 | C02 | sing | 1.51Å | 1.52Å | |
| C05 | C04 | sing | 1.54Å | 1.56Å | |
| C04 | N03 | sing | 1.47Å | 1.46Å | |
| C02 | O01 | doub | 1.21Å | 1.20Å | |
| C02 | N03 | sing | 1.34Å | 1.40Å | |
| C04 | H1 | sing | 1.09Å | 1.10Å | |
| C04 | H2 | sing | 1.09Å | 1.10Å | |
| C05 | H3 | sing | 1.09Å | 1.10Å | |
| C05 | H4 | sing | 1.09Å | 1.10Å | |
| C06 | H5 | sing | 1.09Å | 1.10Å | |
| N03 | H6 | sing | 0.97Å | 1.00Å | |
| N07 | H7 | sing | 1.01Å | 1.00Å | |
| N07 | H8 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N07 | C06 | C05 | 115.3° | 110.5° |
| N07 | C06 | C02 | 109.9° | 110.5° |
| N07 | C06 | H5 | 110.7° | 110.5° |
| C06 | N07 | H7 | 109.5° | 111.0° |
| C06 | N07 | H8 | 109.5° | 111.0° |
| C05 | C06 | C02 | 101.8° | 104.2° |
| C06 | C05 | C04 | 103.6° | 101.8° |
| C06 | C05 | H3 | 110.9° | 110.9° |
| C06 | C05 | H4 | 110.9° | 111.0° |
| C05 | C06 | H5 | 109.2° | 110.5° |
| C06 | C02 | O01 | 129.1° | 124.9° |
| C06 | C02 | N03 | 108.2° | 110.1° |
| C02 | C06 | H5 | 109.5° | 110.5° |
| C05 | C04 | N03 | 101.7° | 105.5° |
| C05 | C04 | H1 | 111.3° | 110.3° |
| C05 | C04 | H2 | 111.4° | 110.2° |
| C04 | C05 | H3 | 110.9° | 111.0° |
| C04 | C05 | H4 | 110.9° | 111.0° |
| C04 | N03 | C02 | 112.2° | 111.3° |
| N03 | C04 | H1 | 111.4° | 110.2° |
| N03 | C04 | H2 | 111.4° | 110.2° |
| C04 | N03 | H6 | 123.9° | 124.4° |
| O01 | C02 | N03 | 122.7° | 124.9° |
| C02 | N03 | H6 | 123.9° | 124.4° |
| H1 | C04 | H2 | 109.5° | 110.2° |
| H3 | C05 | H4 | 109.5° | 110.9° |
| H7 | N07 | H8 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N07 | C06 | C05 | C02 | 118.9° | 118.7° |
| N07 | C06 | C05 | H5 | 125.4° | 122.6° |
| N07 | C06 | C02 | H5 | 121.8° | 122.7° |
| N07 | C06 | C05 | C04 | 152.4° | 94.0° |
| N07 | C06 | C02 | O01 | 35.5° | 77.7° |
| N07 | C06 | C02 | N03 | 144.6° | 102.6° |
| N07 | C06 | C05 | H3 | 33.4° | 147.9° |
| N07 | C06 | C05 | H4 | 88.5° | 24.1° |
| C06 | N07 | H7 | H8 | 120.0° | 123.9° |
| C05 | C06 | C02 | H5 | 115.5° | 118.7° |
| C06 | C05 | C04 | H3 | 119.0° | 118.1° |
| C06 | C05 | C04 | H4 | 119.1° | 118.2° |
| C06 | C05 | C04 | N03 | 33.2° | 25.4° |
| C05 | C06 | C02 | O01 | 158.2° | 163.7° |
| C05 | C06 | C02 | N03 | 21.9° | 16.0° |
| C06 | C05 | C04 | H1 | 152.0° | 93.7° |
| C06 | C05 | C04 | H2 | 85.5° | 144.4° |
| C06 | C05 | H3 | H4 | 122.7° | 123.8° |
| C05 | C06 | N07 | H7 | 180.0° | 179.9° |
| C05 | C06 | N07 | H8 | 60.0° | 56.1° |
| C02 | C06 | C05 | C04 | 33.5° | 24.7° |
| C06 | C02 | N03 | C04 | 0.6° | 0.6° |
| C06 | C02 | O01 | N03 | 180.0° | 179.6° |
| C02 | C06 | C05 | H3 | 85.6° | 93.4° |
| C02 | C06 | C05 | H4 | 152.6° | 142.8° |
| C06 | C02 | N03 | H6 | 179.4° | 179.3° |
| C02 | C06 | N07 | H7 | 65.7° | 65.3° |
| C02 | C06 | N07 | H8 | 174.3° | 170.9° |
| C05 | C04 | N03 | H1 | 118.7° | 119.1° |
| C05 | C04 | N03 | H2 | 118.7° | 119.0° |
| C05 | C04 | N03 | C02 | 20.6° | 17.1° |
| C05 | C04 | H1 | H2 | 123.6° | 121.9° |
| C04 | C05 | H3 | H4 | 122.7° | 123.8° |
| C04 | C05 | C06 | H5 | 82.2° | 143.4° |
| C05 | C04 | N03 | H6 | 159.4° | 162.8° |
| C04 | N03 | C02 | O01 | 179.4° | 179.7° |
| C04 | N03 | C02 | H6 | 180.0° | 179.9° |
| N03 | C04 | H1 | H2 | 123.6° | 121.9° |
| N03 | C04 | C05 | H3 | 85.8° | 92.7° |
| N03 | C04 | C05 | H4 | 152.3° | 143.6° |
| O01 | C02 | C06 | H5 | 86.4° | 45.0° |
| O01 | C02 | N03 | H6 | 0.6° | 0.4° |
| C02 | N03 | C04 | H1 | 139.3° | 102.0° |
| C02 | N03 | C04 | H2 | 98.1° | 136.1° |
| N03 | C02 | C06 | H5 | 93.6° | 134.7° |
| H1 | C04 | C05 | H3 | 32.9° | 148.2° |
| H1 | C04 | C05 | H4 | 89.0° | 24.5° |
| H1 | C04 | N03 | H6 | 40.7° | 78.1° |
| H2 | C04 | C05 | H3 | 155.4° | 26.3° |
| H2 | C04 | C05 | H4 | 33.5° | 97.5° |
| H2 | C04 | N03 | H6 | 81.9° | 43.8° |
| H3 | C05 | C06 | H5 | 158.8° | 25.3° |
| H4 | C05 | C06 | H5 | 36.9° | 98.5° |
| H5 | C06 | N07 | H7 | 55.4° | 57.4° |
| H5 | C06 | N07 | H8 | 64.6° | 66.5° |






