7YO
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O1 | C1 | doub | 1.21Å | 1.20Å | |
C1 | C2 | sing | 1.52Å | 1.46Å | |
C1 | N1 | sing | 1.34Å | 1.31Å | |
C2 | C3 | sing | 1.55Å | 1.50Å | |
N1 | C4 | sing | 1.47Å | 1.45Å | |
C3 | C4 | sing | 1.54Å | 1.50Å | |
C4 | C5 | sing | 1.51Å | 1.49Å | |
C5 | O2 | doub | 1.21Å | 1.19Å | |
C4 | H23 | sing | 1.09Å | 1.10Å | |
N1 | H24 | sing | 0.97Å | 1.00Å | |
C3 | H25 | sing | 1.09Å | 1.10Å | |
C3 | H26 | sing | 1.09Å | 1.10Å | |
C2 | H27 | sing | 1.09Å | 1.10Å | |
C2 | H28 | sing | 1.09Å | 1.10Å | |
C5 | OXT | sing | 1.34Å | 1.29Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O1 | C1 | C2 | 121.4° | 124.9° |
O1 | C1 | N1 | 128.8° | 125.0° |
C2 | C1 | N1 | 109.8° | 110.1° |
C1 | C2 | C3 | 101.2° | 104.2° |
C1 | C2 | H27 | 111.5° | 110.4° |
C1 | C2 | H28 | 111.5° | 110.7° |
C1 | N1 | C4 | 115.1° | 111.3° |
C1 | N1 | H24 | 122.5° | 124.3° |
C2 | C3 | C4 | 107.9° | 101.8° |
C2 | C3 | H25 | 109.9° | 110.9° |
C2 | C3 | H26 | 109.9° | 111.0° |
C3 | C2 | H27 | 111.5° | 110.4° |
C3 | C2 | H28 | 111.5° | 110.5° |
N1 | C4 | C3 | 100.0° | 105.5° |
N1 | C4 | C5 | 117.2° | 110.3° |
N1 | C4 | H23 | 111.9° | 110.3° |
C4 | N1 | H24 | 122.5° | 124.3° |
C3 | C4 | C5 | 104.7° | 110.2° |
C3 | C4 | H23 | 111.1° | 110.3° |
C4 | C3 | H25 | 109.9° | 111.0° |
C4 | C3 | H26 | 109.8° | 111.0° |
C4 | C5 | O2 | 120.3° | 120.0° |
C5 | C4 | H23 | 111.2° | 110.2° |
C4 | C5 | OXT | 118.7° | 120.0° |
O2 | C5 | OXT | 120.9° | 120.0° |
H25 | C3 | H26 | 109.5° | 110.8° |
H27 | C2 | H28 | 109.5° | 110.4° |
C5 | OXT | HXT | 109.5° | 116.9° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O1 | C1 | C2 | N1 | 179.3° | 179.9° |
O1 | C1 | C2 | C3 | 158.8° | 163.7° |
O1 | C1 | N1 | C4 | 170.3° | 179.7° |
O1 | C1 | N1 | H24 | 9.7° | 0.2° |
O1 | C1 | C2 | H27 | 82.6° | 77.8° |
O1 | C1 | C2 | H28 | 40.1° | 44.9° |
C1 | C2 | C3 | H27 | 118.7° | 118.6° |
C1 | C2 | C3 | H28 | 118.7° | 118.9° |
C2 | C1 | N1 | C4 | 8.9° | 0.5° |
C1 | C2 | C3 | C4 | 24.7° | 24.7° |
C2 | C1 | N1 | H24 | 171.1° | 179.7° |
C1 | C2 | C3 | H25 | 144.4° | 142.9° |
C1 | C2 | C3 | H26 | 95.1° | 93.5° |
C1 | C2 | H27 | H28 | 123.8° | 122.8° |
N1 | C1 | C2 | C3 | 20.5° | 16.2° |
C1 | N1 | C4 | H24 | 180.0° | 179.9° |
C1 | N1 | C4 | C3 | 7.0° | 17.0° |
C1 | N1 | C4 | C5 | 105.3° | 136.0° |
C1 | N1 | C4 | H23 | 124.6° | 102.1° |
N1 | C1 | C2 | H27 | 98.1° | 102.4° |
N1 | C1 | C2 | H28 | 139.2° | 135.0° |
C2 | C3 | C4 | N1 | 19.7° | 25.4° |
C2 | C3 | C4 | H25 | 119.8° | 118.1° |
C2 | C3 | C4 | H26 | 119.7° | 118.2° |
C2 | C3 | C4 | C5 | 102.0° | 144.4° |
C2 | C3 | C4 | H23 | 137.9° | 93.7° |
C2 | C3 | H25 | H26 | 120.7° | 123.8° |
C3 | C2 | H27 | H28 | 123.8° | 122.6° |
N1 | C4 | C3 | C5 | 121.7° | 119.0° |
N1 | C4 | C3 | H23 | 118.2° | 119.1° |
N1 | C4 | C5 | H23 | 130.4° | 122.0° |
N1 | C4 | C5 | O2 | 62.3° | 17.3° |
N1 | C4 | C3 | H25 | 139.5° | 143.5° |
N1 | C4 | C3 | H26 | 100.0° | 92.8° |
N1 | C4 | C5 | OXT | 117.9° | 162.3° |
C3 | C4 | C5 | H23 | 120.0° | 121.9° |
C3 | C4 | C5 | O2 | 47.4° | 98.8° |
C3 | C4 | N1 | H24 | 173.0° | 163.1° |
C4 | C3 | H25 | H26 | 120.7° | 123.8° |
C4 | C3 | C2 | H27 | 94.0° | 93.9° |
C4 | C3 | C2 | H28 | 143.3° | 143.6° |
C3 | C4 | C5 | OXT | 132.5° | 81.5° |
C4 | C5 | O2 | OXT | 179.9° | 179.7° |
C5 | C4 | N1 | H24 | 74.7° | 44.1° |
C5 | C4 | C3 | H25 | 17.8° | 97.5° |
C5 | C4 | C3 | H26 | 138.3° | 26.3° |
C4 | C5 | OXT | HXT | 179.9° | 179.7° |
O2 | C5 | C4 | H23 | 167.4° | 139.3° |
O2 | C5 | OXT | HXT | 0.0° | 0.1° |
H23 | C4 | N1 | H24 | 55.3° | 77.8° |
H23 | C4 | C3 | H25 | 102.3° | 24.4° |
H23 | C4 | C3 | H26 | 18.2° | 148.1° |
H23 | C4 | C5 | OXT | 12.5° | 40.4° |
H25 | C3 | C2 | H27 | 25.8° | 24.3° |
H25 | C3 | C2 | H28 | 96.9° | 98.2° |
H26 | C3 | C2 | H27 | 146.3° | 148.0° |
H26 | C3 | C2 | H28 | 23.6° | 25.5° |