6IU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAC | CAB | doub | 1.21Å | 1.23Å | |
| CAA | CAB | sing | 1.51Å | 1.54Å | |
| CAF | CAE | sing | 1.53Å | 1.55Å | |
| CAF | NAG | sing | 1.47Å | 1.48Å | |
| CAB | NAD | sing | 1.35Å | 1.36Å | |
| NAD | CAE | sing | 1.47Å | 1.49Å | |
| O | C | doub | 1.21Å | 1.23Å | |
| NAG | C | sing | 1.35Å | 1.36Å | |
| C | CA | sing | 1.51Å | 1.59Å | |
| CA | N | sing | 1.47Å | 1.50Å | |
| N | OAL | doub | 1.22Å | 1.60Å | |
| N | OAM | sing | 1.22Å | 1.54Å | |
| CA | H1 | sing | 1.09Å | 1.10Å | |
| CA | H2 | sing | 1.09Å | 1.10Å | |
| NAG | H3 | sing | 0.97Å | 1.00Å | |
| CAF | H4 | sing | 1.09Å | 1.10Å | |
| CAF | H5 | sing | 1.09Å | 1.10Å | |
| CAE | H6 | sing | 1.09Å | 1.10Å | |
| CAE | H7 | sing | 1.09Å | 1.10Å | |
| NAD | H8 | sing | 0.97Å | 1.00Å | |
| CAA | H9 | sing | 1.09Å | 1.10Å | |
| CAA | H10 | sing | 1.09Å | 1.10Å | |
| CAA | H11 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAC | CAB | CAA | 119.8° | 120.0° |
| OAC | CAB | NAD | 126.0° | 120.0° |
| CAA | CAB | NAD | 114.2° | 119.9° |
| CAB | CAA | H9 | 109.5° | 109.5° |
| CAB | CAA | H10 | 109.5° | 109.5° |
| CAB | CAA | H11 | 109.4° | 109.4° |
| CAE | CAF | NAG | 108.4° | 109.5° |
| CAF | CAE | NAD | 107.9° | 109.5° |
| CAE | CAF | H4 | 109.7° | 109.5° |
| CAE | CAF | H5 | 109.7° | 109.5° |
| CAF | CAE | H6 | 109.8° | 109.5° |
| CAF | CAE | H7 | 109.9° | 109.5° |
| CAF | NAG | C | 125.0° | 120.0° |
| CAF | NAG | H3 | 117.6° | 120.0° |
| NAG | CAF | H4 | 109.7° | 109.5° |
| NAG | CAF | H5 | 109.7° | 109.4° |
| CAB | NAD | CAE | 126.2° | 120.0° |
| CAB | NAD | H8 | 116.9° | 120.0° |
| NAD | CAE | H6 | 109.9° | 109.5° |
| NAD | CAE | H7 | 109.8° | 109.5° |
| CAE | NAD | H8 | 116.9° | 120.0° |
| O | C | NAG | 121.8° | 120.0° |
| O | C | CA | 122.6° | 120.0° |
| NAG | C | CA | 115.7° | 120.0° |
| C | NAG | H3 | 117.5° | 119.9° |
| C | CA | N | 112.0° | 109.5° |
| C | CA | H1 | 108.8° | 109.5° |
| C | CA | H2 | 108.8° | 109.5° |
| CA | N | OAL | 125.5° | 119.9° |
| CA | N | OAM | 122.2° | 120.0° |
| N | CA | H1 | 108.8° | 109.4° |
| N | CA | H2 | 108.8° | 109.5° |
| OAL | N | OAM | 112.3° | 120.0° |
| H1 | CA | H2 | 109.5° | 109.5° |
| H4 | CAF | H5 | 109.5° | 109.5° |
| H6 | CAE | H7 | 109.5° | 109.5° |
| H9 | CAA | H10 | 109.5° | 109.5° |
| H9 | CAA | H11 | 109.5° | 109.5° |
| H10 | CAA | H11 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAC | CAB | CAA | NAD | 178.9° | 180.0° |
| OAC | CAB | NAD | CAE | 0.9° | 0.1° |
| OAC | CAB | NAD | H8 | 179.1° | 180.0° |
| OAC | CAB | CAA | H9 | 0.0° | 180.0° |
| OAC | CAB | CAA | H10 | 120.0° | 60.0° |
| OAC | CAB | CAA | H11 | 120.0° | 60.0° |
| CAA | CAB | NAD | CAE | 178.0° | 180.0° |
| CAA | CAB | NAD | H8 | 2.0° | 0.0° |
| CAB | CAA | H9 | H10 | 120.0° | 120.0° |
| CAB | CAA | H9 | H11 | 120.0° | 120.0° |
| CAB | CAA | H10 | H11 | 120.0° | 119.9° |
| CAE | CAF | NAG | H4 | 119.9° | 120.0° |
| CAE | CAF | NAG | H5 | 119.8° | 120.0° |
| CAF | CAE | NAD | CAB | 165.2° | 180.0° |
| CAF | CAE | NAD | H6 | 119.8° | 120.0° |
| CAF | CAE | NAD | H7 | 119.8° | 120.0° |
| CAE | CAF | NAG | C | 135.8° | 180.0° |
| CAE | CAF | NAG | H3 | 44.2° | 0.0° |
| CAE | CAF | H4 | H5 | 120.4° | 120.1° |
| CAF | CAE | H6 | H7 | 120.7° | 120.0° |
| CAF | CAE | NAD | H8 | 14.8° | 0.0° |
| NAG | CAF | CAE | NAD | 105.6° | 180.0° |
| CAF | NAG | C | O | 1.6° | 0.0° |
| CAF | NAG | C | H3 | 180.0° | 180.0° |
| CAF | NAG | C | CA | 179.0° | 180.0° |
| NAG | CAF | H4 | H5 | 120.5° | 119.9° |
| NAG | CAF | CAE | H6 | 134.6° | 60.0° |
| NAG | CAF | CAE | H7 | 14.2° | 60.0° |
| CAB | NAD | CAE | H8 | 180.0° | 179.9° |
| CAB | NAD | CAE | H6 | 45.5° | 60.0° |
| CAB | NAD | CAE | H7 | 75.0° | 60.0° |
| NAD | CAB | CAA | H9 | 178.9° | 0.0° |
| NAD | CAB | CAA | H10 | 61.1° | 120.0° |
| NAD | CAB | CAA | H11 | 58.9° | 120.1° |
| NAD | CAE | CAF | H4 | 134.5° | 60.0° |
| NAD | CAE | CAF | H5 | 14.2° | 60.0° |
| NAD | CAE | H6 | H7 | 120.7° | 120.0° |
| O | C | NAG | CA | 179.5° | 180.0° |
| O | C | CA | N | 90.0° | 0.0° |
| O | C | CA | H1 | 30.4° | 120.0° |
| O | C | CA | H2 | 149.6° | 120.0° |
| O | C | NAG | H3 | 178.4° | 180.0° |
| NAG | C | CA | N | 90.5° | 180.0° |
| NAG | C | CA | H1 | 149.1° | 60.0° |
| NAG | C | CA | H2 | 29.8° | 60.0° |
| C | NAG | CAF | H4 | 16.0° | 59.9° |
| C | NAG | CAF | H5 | 104.3° | 60.0° |
| C | CA | N | H1 | 120.4° | 120.0° |
| C | CA | N | H2 | 120.4° | 120.0° |
| C | CA | N | OAL | 92.1° | 45.0° |
| C | CA | N | OAM | 87.2° | 135.3° |
| C | CA | H1 | H2 | 118.8° | 120.0° |
| CA | C | NAG | H3 | 1.0° | 0.0° |
| CA | N | OAL | OAM | 179.4° | 179.7° |
| N | CA | H1 | H2 | 118.8° | 120.0° |
| OAL | N | CA | H1 | 28.3° | 165.0° |
| OAL | N | CA | H2 | 147.5° | 75.0° |
| OAM | N | CA | H1 | 152.4° | 15.3° |
| OAM | N | CA | H2 | 33.1° | 104.7° |
| H3 | NAG | CAF | H4 | 164.0° | 120.1° |
| H3 | NAG | CAF | H5 | 75.7° | 120.0° |
| H4 | CAF | CAE | H6 | 14.7° | 180.0° |
| H4 | CAF | CAE | H7 | 105.7° | 60.0° |
| H5 | CAF | CAE | H6 | 105.6° | 60.0° |
| H5 | CAF | CAE | H7 | 134.0° | 180.0° |
| H6 | CAE | NAD | H8 | 134.6° | 120.0° |
| H7 | CAE | NAD | H8 | 105.0° | 120.0° |
| H9 | CAA | H10 | H11 | 120.0° | 120.0° |
