O7U
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | sing | 1.32Å | 1.40Å | |
| N1 | C6 | sing | 1.37Å | 1.46Å | |
| C2 | O2 | doub | 1.22Å | 1.25Å | |
| C2 | N3 | sing | 1.35Å | 1.37Å | |
| N3 | P4 | sing | 1.66Å | 1.63Å | |
| N4 | P4 | sing | 1.68Å | 1.63Å | |
| O4 | P4 | doub | 1.48Å | 1.47Å | |
| P4 | C5 | sing | 1.84Å | 1.79Å | |
| C5 | C6 | doub | 1.33Å | 1.28Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| N3 | HN3 | sing | 0.97Å | 1.00Å | |
| N4 | HN4 | sing | 1.01Å | 1.00Å | |
| N4 | HN4A | sing | 1.01Å | 1.00Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | C6 | 122.9° | 132.0° |
| N1 | C2 | O2 | 125.4° | 117.2° |
| N1 | C2 | N3 | 117.8° | 125.4° |
| C2 | N1 | HN1 | 118.5° | 114.0° |
| N1 | C6 | C5 | 129.8° | 121.9° |
| C6 | N1 | HN1 | 118.6° | 114.0° |
| N1 | C6 | H6 | 115.1° | 119.1° |
| O2 | C2 | N3 | 116.7° | 117.3° |
| C2 | N3 | P4 | 127.4° | 114.3° |
| C2 | N3 | HN3 | 116.3° | 122.9° |
| N3 | P4 | N4 | 110.5° | 108.9° |
| N3 | P4 | O4 | 104.4° | 108.8° |
| N3 | P4 | C5 | 106.9° | 112.9° |
| P4 | N3 | HN3 | 116.3° | 122.9° |
| N4 | P4 | O4 | 109.5° | 108.8° |
| N4 | P4 | C5 | 112.1° | 108.8° |
| P4 | N4 | HN4 | 109.5° | 111.0° |
| P4 | N4 | HN4A | 109.5° | 111.0° |
| O4 | P4 | C5 | 113.2° | 108.7° |
| P4 | C5 | C6 | 115.1° | 113.5° |
| P4 | C5 | H5 | 122.4° | 123.3° |
| C6 | C5 | H5 | 122.5° | 123.2° |
| C5 | C6 | H6 | 115.1° | 119.0° |
| HN4 | N4 | HN4A | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | N1 | C6 | HN1 | 180.0° | 179.6° |
| N1 | C2 | O2 | N3 | 178.3° | 180.0° |
| N1 | C2 | N3 | P4 | 4.1° | 0.0° |
| C2 | N1 | C6 | C5 | 0.8° | 0.0° |
| N1 | C2 | N3 | HN3 | 175.9° | 179.9° |
| C2 | N1 | C6 | H6 | 179.2° | 179.9° |
| C6 | N1 | C2 | O2 | 179.1° | 180.0° |
| C6 | N1 | C2 | N3 | 0.8° | 0.0° |
| N1 | C6 | C5 | P4 | 0.7° | 0.0° |
| N1 | C6 | C5 | H6 | 180.0° | 180.0° |
| N1 | C6 | C5 | H5 | 179.3° | 179.9° |
| O2 | C2 | N3 | P4 | 177.4° | 180.0° |
| O2 | C2 | N1 | HN1 | 1.0° | 0.4° |
| O2 | C2 | N3 | HN3 | 2.6° | 0.0° |
| C2 | N3 | P4 | HN3 | 180.0° | 179.9° |
| C2 | N3 | P4 | N4 | 127.2° | 120.8° |
| C2 | N3 | P4 | O4 | 115.2° | 120.8° |
| C2 | N3 | P4 | C5 | 5.1° | 0.1° |
| N3 | C2 | N1 | HN1 | 179.3° | 179.6° |
| N3 | P4 | N4 | O4 | 114.5° | 118.4° |
| N3 | P4 | N4 | C5 | 119.1° | 123.4° |
| N3 | P4 | O4 | C5 | 115.9° | 123.2° |
| N3 | P4 | C5 | C6 | 3.1° | 0.1° |
| N3 | P4 | N4 | HN4 | 180.0° | 180.0° |
| N3 | P4 | N4 | HN4A | 60.0° | 56.0° |
| N3 | P4 | C5 | H5 | 176.9° | 180.0° |
| N4 | P4 | O4 | C5 | 125.8° | 118.3° |
| N4 | P4 | C5 | C6 | 124.3° | 120.9° |
| N4 | P4 | N3 | HN3 | 52.8° | 59.1° |
| P4 | N4 | HN4 | HN4A | 120.0° | 124.0° |
| N4 | P4 | C5 | H5 | 55.7° | 59.0° |
| O4 | P4 | C5 | C6 | 111.3° | 120.8° |
| O4 | P4 | N3 | HN3 | 64.8° | 59.3° |
| O4 | P4 | N4 | HN4 | 65.6° | 61.6° |
| O4 | P4 | N4 | HN4A | 174.4° | 174.4° |
| O4 | P4 | C5 | H5 | 68.7° | 59.3° |
| P4 | C5 | C6 | H5 | 180.0° | 179.9° |
| C5 | P4 | N3 | HN3 | 174.9° | 180.0° |
| C5 | P4 | N4 | HN4 | 60.9° | 56.6° |
| C5 | P4 | N4 | HN4A | 59.1° | 67.4° |
| P4 | C5 | C6 | H6 | 179.3° | 180.0° |
| C5 | C6 | N1 | HN1 | 179.2° | 179.6° |
| HN1 | N1 | C6 | H6 | 0.8° | 0.3° |
| H5 | C5 | C6 | H6 | 0.8° | 0.1° |
