6V1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C6 | C3 | sing | 1.53Å | 1.52Å | |
| C6 | N3 | sing | 1.46Å | 1.48Å | |
| O8 | C4 | doub | 1.21Å | 1.24Å | |
| C4 | N3 | sing | 1.34Å | 1.34Å | |
| C4 | C5 | sing | 1.52Å | 1.53Å | |
| N3 | C2 | sing | 1.34Å | 1.36Å | |
| C5 | C1 | sing | 1.54Å | 1.54Å | |
| C2 | O7 | doub | 1.21Å | 1.22Å | |
| C2 | C1 | sing | 1.51Å | 1.53Å | |
| C1 | SG | sing | 1.81Å | 1.81Å | |
| SG | CB | sing | 1.81Å | 1.76Å | |
| CB | CA | sing | 1.53Å | 1.57Å | |
| CA | C | sing | 1.51Å | 1.51Å | |
| CA | N | sing | 1.47Å | 1.44Å | |
| C | O | doub | 1.21Å | 1.19Å | |
| C | O1 | sing | 1.34Å | 1.33Å | |
| N | H1 | sing | 1.01Å | 1.00Å | |
| N | H2 | sing | 1.01Å | 1.00Å | |
| CA | H4 | sing | 1.09Å | 1.10Å | |
| CB | H5 | sing | 1.09Å | 1.10Å | |
| CB | H6 | sing | 1.09Å | 1.10Å | |
| C1 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C5 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H11 | sing | 1.09Å | 1.10Å | |
| C3 | H12 | sing | 1.09Å | 1.10Å | |
| C3 | H13 | sing | 1.09Å | 1.10Å | |
| C3 | H14 | sing | 1.09Å | 1.10Å | |
| O1 | H15 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | C6 | N3 | 118.9° | 109.5° |
| C3 | C6 | H10 | 107.1° | 109.4° |
| C3 | C6 | H11 | 107.1° | 109.5° |
| C6 | C3 | H12 | 109.5° | 109.5° |
| C6 | C3 | H13 | 109.5° | 109.5° |
| C6 | C3 | H14 | 109.5° | 109.5° |
| C6 | N3 | C4 | 121.5° | 122.8° |
| C6 | N3 | C2 | 129.6° | 122.8° |
| N3 | C6 | H10 | 107.0° | 109.5° |
| N3 | C6 | H11 | 107.0° | 109.5° |
| O8 | C4 | N3 | 123.2° | 125.4° |
| O8 | C4 | C5 | 125.5° | 125.4° |
| N3 | C4 | C5 | 111.3° | 109.3° |
| C4 | N3 | C2 | 108.9° | 114.5° |
| C4 | C5 | C1 | 102.7° | 103.4° |
| C4 | C5 | H8 | 111.2° | 110.7° |
| C4 | C5 | H9 | 111.2° | 110.6° |
| N3 | C2 | O7 | 125.0° | 125.4° |
| N3 | C2 | C1 | 110.3° | 109.2° |
| C5 | C1 | C2 | 101.2° | 103.6° |
| C5 | C1 | SG | 119.8° | 110.6° |
| C5 | C1 | H7 | 108.2° | 110.6° |
| C1 | C5 | H8 | 111.2° | 110.5° |
| C1 | C5 | H9 | 111.1° | 110.7° |
| O7 | C2 | C1 | 124.6° | 125.3° |
| C2 | C1 | SG | 113.5° | 110.6° |
| C2 | C1 | H7 | 108.4° | 110.6° |
| C1 | SG | CB | 98.2° | 103.0° |
| SG | C1 | H7 | 105.4° | 110.5° |
| SG | CB | CA | 106.4° | 109.4° |
| SG | CB | H5 | 110.2° | 109.5° |
| SG | CB | H6 | 110.2° | 109.5° |
| CB | CA | C | 102.4° | 109.4° |
| CB | CA | N | 113.6° | 109.5° |
| CB | CA | H4 | 109.4° | 109.5° |
| CA | CB | H5 | 110.2° | 109.4° |
| CA | CB | H6 | 110.2° | 109.5° |
| C | CA | N | 109.7° | 109.4° |
| CA | C | O | 118.5° | 120.0° |
| CA | C | O1 | 117.6° | 120.0° |
| C | CA | H4 | 110.2° | 109.5° |
| CA | N | H1 | 109.5° | 111.0° |
| CA | N | H2 | 109.5° | 111.0° |
| N | CA | H4 | 111.2° | 109.5° |
| O | C | O1 | 122.9° | 120.0° |
| C | O1 | H15 | 109.5° | 117.0° |
| H1 | N | H2 | 109.5° | 111.0° |
| H5 | CB | H6 | 109.5° | 109.5° |
| H8 | C5 | H9 | 109.4° | 110.7° |
| H10 | C6 | H11 | 109.5° | 109.5° |
| H12 | C3 | H13 | 109.5° | 109.4° |
| H12 | C3 | H14 | 109.5° | 109.5° |
| H13 | C3 | H14 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C3 | C6 | N3 | H10 | 121.3° | 120.0° |
| C3 | C6 | N3 | H11 | 121.4° | 120.0° |
| C3 | C6 | N3 | C4 | 171.7° | 90.0° |
| C3 | C6 | N3 | C2 | 11.3° | 90.0° |
| C3 | C6 | H10 | H11 | 115.7° | 120.0° |
| C6 | C3 | H12 | H13 | 120.0° | 120.0° |
| C6 | C3 | H12 | H14 | 120.0° | 120.0° |
| C6 | C3 | H13 | H14 | 120.0° | 120.0° |
| C6 | N3 | C4 | O8 | 22.0° | 0.0° |
| C6 | N3 | C4 | C2 | 177.5° | 180.0° |
| C6 | N3 | C4 | C5 | 160.4° | 179.9° |
| C6 | N3 | C2 | O7 | 25.6° | 0.0° |
| C6 | N3 | C2 | C1 | 152.1° | 180.0° |
| N3 | C6 | H10 | H11 | 115.7° | 120.0° |
| N3 | C6 | C3 | H12 | 180.0° | 60.0° |
| N3 | C6 | C3 | H13 | 60.0° | 60.0° |
| N3 | C6 | C3 | H14 | 60.0° | 180.0° |
| O8 | C4 | N3 | C5 | 177.6° | 179.9° |
| O8 | C4 | N3 | C2 | 160.4° | 180.0° |
| O8 | C4 | C5 | C1 | 175.0° | 180.0° |
| O8 | C4 | C5 | H8 | 66.1° | 61.6° |
| O8 | C4 | C5 | H9 | 56.0° | 61.5° |
| N3 | C4 | C5 | C1 | 2.6° | 0.1° |
| C4 | N3 | C2 | O7 | 157.1° | 180.0° |
| C4 | N3 | C2 | C1 | 25.2° | 0.0° |
| N3 | C4 | C5 | H8 | 116.4° | 118.5° |
| N3 | C4 | C5 | H9 | 121.5° | 118.5° |
| C4 | N3 | C6 | H10 | 66.9° | 30.0° |
| C4 | N3 | C6 | H11 | 50.4° | 150.0° |
| C5 | C4 | N3 | C2 | 17.1° | 0.1° |
| C4 | C5 | C1 | H8 | 118.9° | 118.5° |
| C4 | C5 | C1 | H9 | 118.9° | 118.5° |
| C4 | C5 | C1 | C2 | 10.9° | 0.1° |
| C4 | C5 | C1 | SG | 136.4° | 118.5° |
| C4 | C5 | C1 | H7 | 102.9° | 118.7° |
| C4 | C5 | H8 | H9 | 123.2° | 123.0° |
| N3 | C2 | C1 | C5 | 22.1° | 0.0° |
| N3 | C2 | O7 | C1 | 177.4° | 179.9° |
| N3 | C2 | C1 | SG | 151.8° | 118.5° |
| N3 | C2 | C1 | H7 | 91.5° | 118.6° |
| C2 | N3 | C6 | H10 | 110.1° | 150.0° |
| C2 | N3 | C6 | H11 | 132.6° | 30.0° |
| C5 | C1 | C2 | O7 | 160.1° | 179.9° |
| C5 | C1 | C2 | SG | 129.6° | 118.6° |
| C5 | C1 | C2 | H7 | 113.7° | 118.6° |
| C5 | C1 | SG | H7 | 122.1° | 122.9° |
| C5 | C1 | SG | CB | 164.0° | 177.2° |
| C1 | C5 | H8 | H9 | 123.1° | 123.1° |
| O7 | C2 | C1 | SG | 30.5° | 61.5° |
| O7 | C2 | C1 | H7 | 86.2° | 61.3° |
| C2 | C1 | SG | H7 | 118.4° | 122.9° |
| C2 | C1 | SG | CB | 76.5° | 68.6° |
| C2 | C1 | C5 | H8 | 129.8° | 118.5° |
| C2 | C1 | C5 | H9 | 108.0° | 118.4° |
| C1 | SG | CB | CA | 132.3° | 180.0° |
| C1 | SG | CB | H5 | 12.8° | 60.1° |
| C1 | SG | CB | H6 | 108.1° | 60.0° |
| SG | C1 | C5 | H8 | 104.6° | 0.1° |
| SG | C1 | C5 | H9 | 17.5° | 123.0° |
| SG | CB | CA | H5 | 119.5° | 120.0° |
| SG | CB | CA | H6 | 119.5° | 120.0° |
| SG | CB | CA | C | 167.1° | 180.0° |
| SG | CB | CA | N | 48.9° | 60.0° |
| SG | CB | CA | H4 | 76.0° | 60.1° |
| SG | CB | H5 | H6 | 121.4° | 120.1° |
| CB | SG | C1 | H7 | 42.0° | 54.3° |
| CB | CA | C | N | 120.9° | 120.0° |
| CB | CA | C | H4 | 116.3° | 120.0° |
| CB | CA | N | H4 | 124.0° | 120.1° |
| CB | CA | C | O | 93.0° | 100.0° |
| CB | CA | C | O1 | 75.9° | 80.0° |
| CB | CA | N | H1 | 180.0° | 176.0° |
| CB | CA | N | H2 | 60.0° | 60.0° |
| CA | CB | H5 | H6 | 121.4° | 120.0° |
| C | CA | N | H4 | 122.2° | 120.0° |
| CA | C | O | O1 | 168.3° | 180.0° |
| C | CA | N | H1 | 66.1° | 64.0° |
| C | CA | N | H2 | 53.9° | 60.0° |
| C | CA | CB | H5 | 73.4° | 60.0° |
| C | CA | CB | H6 | 47.6° | 60.0° |
| CA | C | O1 | H15 | 168.4° | 180.0° |
| N | CA | C | O | 27.9° | 19.9° |
| N | CA | C | O1 | 163.2° | 160.0° |
| CA | N | H1 | H2 | 120.0° | 124.0° |
| N | CA | CB | H5 | 168.4° | 59.9° |
| N | CA | CB | H6 | 70.6° | 180.0° |
| O | C | CA | H4 | 150.7° | 140.0° |
| O | C | O1 | H15 | 0.0° | 0.0° |
| O1 | C | CA | H4 | 40.4° | 40.0° |
| H1 | N | CA | H4 | 56.0° | 56.0° |
| H2 | N | CA | H4 | 176.1° | 180.0° |
| H4 | CA | CB | H5 | 43.5° | 180.0° |
| H4 | CA | CB | H6 | 164.4° | 59.9° |
| H7 | C1 | C5 | H8 | 16.1° | 122.9° |
| H7 | C1 | C5 | H9 | 138.2° | 0.2° |
| H10 | C6 | C3 | H12 | 58.7° | 180.0° |
| H10 | C6 | C3 | H13 | 61.3° | 60.0° |
| H10 | C6 | C3 | H14 | 178.7° | 60.0° |
| H11 | C6 | C3 | H12 | 58.7° | 60.0° |
| H11 | C6 | C3 | H13 | 178.6° | 180.0° |
| H11 | C6 | C3 | H14 | 61.4° | 60.0° |
| H12 | C3 | H13 | H14 | 120.0° | 120.0° |
