PGA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| P | O1P | sing | 1.61Å | 1.61Å | |
| P | O2P | doub | 1.48Å | 1.52Å | |
| P | O3P | sing | 1.61Å | 1.50Å | |
| P | O4P | sing | 1.61Å | 1.60Å | |
| O1P | C2 | sing | 1.43Å | 1.41Å | |
| O3P | HOP3 | sing | 0.97Å | 0.95Å | |
| O4P | HOP4 | sing | 0.97Å | 0.95Å | |
| C2 | C1 | sing | 1.51Å | 1.52Å | |
| C2 | H21 | sing | 1.09Å | 1.11Å | |
| C2 | H22 | sing | 1.09Å | 1.11Å | |
| C1 | O1 | doub | 1.21Å | 1.30Å | |
| C1 | O2 | sing | 1.34Å | 1.22Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1P | P | O2P | 114.6° | 109.4° |
| O1P | P | O3P | 96.8° | 109.5° |
| O1P | P | O4P | 91.7° | 109.5° |
| P | O1P | C2 | 111.9° | 106.9° |
| O2P | P | O3P | 123.0° | 109.5° |
| O2P | P | O4P | 110.5° | 109.4° |
| O3P | P | O4P | 115.0° | 109.5° |
| P | O3P | HOP3 | 96.8° | 106.9° |
| P | O4P | HOP4 | 91.7° | 106.8° |
| O1P | C2 | C1 | 105.8° | 109.5° |
| O1P | C2 | H21 | 113.6° | 109.5° |
| O1P | C2 | H22 | 113.6° | 109.4° |
| C1 | C2 | H21 | 113.5° | 109.5° |
| C1 | C2 | H22 | 113.5° | 109.5° |
| C2 | C1 | O1 | 117.6° | 120.0° |
| C2 | C1 | O2 | 122.5° | 120.0° |
| H21 | C2 | H22 | 97.0° | 109.4° |
| O1 | C1 | O2 | 119.8° | 120.0° |
| C1 | O2 | HO2 | 122.5° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1P | P | O2P | O3P | 116.9° | 120.0° |
| O1P | P | O2P | O4P | 101.8° | 120.0° |
| O1P | P | O3P | O4P | 95.1° | 120.1° |
| O1P | P | O3P | HOP3 | 180.0° | 179.9° |
| O1P | P | O4P | HOP4 | 180.0° | 60.1° |
| P | O1P | C2 | C1 | 168.7° | 180.0° |
| P | O1P | C2 | H21 | 43.5° | 59.9° |
| P | O1P | C2 | H22 | 66.1° | 60.0° |
| O2P | P | O3P | O4P | 139.7° | 120.0° |
| O2P | P | O1P | C2 | 62.8° | 60.0° |
| O2P | P | O3P | HOP3 | 54.8° | 60.0° |
| O2P | P | O4P | HOP4 | 62.9° | 180.0° |
| O3P | P | O1P | C2 | 68.3° | 180.0° |
| O3P | P | O4P | HOP4 | 81.7° | 60.0° |
| O4P | P | O1P | C2 | 176.3° | 59.9° |
| O4P | P | O3P | HOP3 | 84.9° | 60.0° |
| O1P | C2 | C1 | H21 | 125.2° | 120.1° |
| O1P | C2 | C1 | H22 | 125.2° | 119.9° |
| O1P | C2 | H21 | H22 | 119.5° | 119.9° |
| O1P | C2 | C1 | O1 | 150.2° | 0.1° |
| O1P | C2 | C1 | O2 | 32.9° | 180.0° |
| C1 | C2 | H21 | H22 | 119.5° | 120.0° |
| C2 | C1 | O1 | O2 | 177.0° | 179.9° |
| C2 | C1 | O2 | HO2 | 180.0° | 180.0° |
| H21 | C2 | C1 | O1 | 25.0° | 120.0° |
| H21 | C2 | C1 | O2 | 158.1° | 59.9° |
| H22 | C2 | C1 | O1 | 84.6° | 120.0° |
| H22 | C2 | C1 | O2 | 92.3° | 60.1° |
| O1 | C1 | O2 | HO2 | 3.2° | 0.1° |
