ZF9
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O10 | P06 | doub | 1.48Å | 1.46Å | |
O12 | P06 | sing | 1.61Å | 1.50Å | |
O17 | P03 | doub | 1.48Å | 1.46Å | |
O19 | P02 | doub | 1.48Å | 1.46Å | |
O09 | P06 | sing | 1.61Å | 1.68Å | |
O09 | P05 | sing | 1.61Å | 1.67Å | |
P06 | O11 | sing | 1.61Å | 1.47Å | |
O18 | P03 | sing | 1.61Å | 1.46Å | |
O08 | P05 | sing | 1.61Å | 1.66Å | |
O08 | P04 | sing | 1.61Å | 1.66Å | |
P03 | O06 | sing | 1.61Å | 1.65Å | |
P03 | O07 | sing | 1.61Å | 1.64Å | |
O20 | P02 | sing | 1.61Å | 1.46Å | |
P02 | O06 | sing | 1.61Å | 1.65Å | |
P02 | O05 | sing | 1.61Å | 1.66Å | |
O15 | P04 | doub | 1.48Å | 1.47Å | |
P05 | O14 | doub | 1.48Å | 1.47Å | |
P05 | O13 | sing | 1.61Å | 1.46Å | |
P04 | O07 | sing | 1.61Å | 1.64Å | |
P04 | O16 | sing | 1.61Å | 1.47Å | |
O05 | P01 | sing | 1.61Å | 1.66Å | |
P01 | O04 | sing | 1.61Å | 1.66Å | |
P01 | O22 | doub | 1.48Å | 1.46Å | |
P01 | O21 | sing | 1.61Å | 1.46Å | |
O04 | C10 | sing | 1.43Å | 1.40Å | |
C09 | C10 | sing | 1.53Å | 1.50Å | |
C09 | O02 | sing | 1.44Å | 1.46Å | |
C09 | C01 | sing | 1.54Å | 1.49Å | |
O01 | C01 | sing | 1.43Å | 1.43Å | |
O02 | C03 | sing | 1.44Å | 1.47Å | |
C01 | C02 | sing | 1.55Å | 1.47Å | |
C03 | C02 | sing | 1.55Å | 1.50Å | |
C03 | N01 | sing | 1.47Å | 1.43Å | |
C02 | O03 | sing | 1.43Å | 1.44Å | |
N01 | C04 | sing | 1.36Å | 1.33Å | Aromatic |
N01 | C06 | sing | 1.37Å | 1.33Å | Aromatic |
C04 | N02 | doub | 1.30Å | 1.35Å | Aromatic |
C06 | N03 | doub | 1.33Å | 1.33Å | Aromatic |
C06 | C05 | sing | 1.41Å | 1.42Å | Aromatic |
N03 | C07 | sing | 1.32Å | 1.35Å | Aromatic |
N02 | C05 | sing | 1.35Å | 1.46Å | Aromatic |
C05 | C08 | doub | 1.40Å | 1.36Å | Aromatic |
C07 | N04 | doub | 1.32Å | 1.34Å | Aromatic |
C08 | N04 | sing | 1.33Å | 1.32Å | Aromatic |
C08 | N05 | sing | 1.38Å | 1.45Å | |
C10 | H1 | sing | 1.09Å | 1.10Å | |
C10 | H2 | sing | 1.09Å | 1.10Å | |
C01 | H3 | sing | 1.09Å | 1.10Å | |
C02 | H4 | sing | 1.09Å | 1.10Å | |
C03 | H5 | sing | 1.09Å | 1.10Å | |
C04 | H6 | sing | 1.08Å | 1.08Å | |
C07 | H7 | sing | 1.08Å | 1.08Å | |
C09 | H8 | sing | 1.09Å | 1.10Å | |
N05 | H9 | sing | 0.97Å | 1.00Å | |
N05 | H10 | sing | 0.97Å | 1.00Å | |
O01 | H11 | sing | 0.97Å | 0.95Å | |
O03 | H12 | sing | 0.97Å | 0.95Å | |
O11 | H13 | sing | 0.97Å | 0.95Å | |
O12 | H14 | sing | 0.97Å | 0.95Å | |
O13 | H15 | sing | 0.97Å | 0.95Å | |
O16 | H16 | sing | 0.97Å | 0.95Å | |
O18 | H17 | sing | 0.97Å | 0.95Å | |
O20 | H18 | sing | 0.97Å | 0.95Å | |
O21 | H19 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O10 | P06 | O12 | 103.8° | 109.5° |
O10 | P06 | O09 | 112.7° | 109.5° |
O10 | P06 | O11 | 100.4° | 109.5° |
O12 | P06 | O09 | 118.4° | 109.5° |
O12 | P06 | O11 | 106.1° | 109.5° |
P06 | O12 | H14 | 109.5° | 114.0° |
O17 | P03 | O18 | 100.9° | 109.4° |
O17 | P03 | O06 | 111.7° | 109.5° |
O17 | P03 | O07 | 111.1° | 109.5° |
O19 | P02 | O20 | 101.2° | 109.5° |
O19 | P02 | O06 | 108.8° | 109.5° |
O19 | P02 | O05 | 111.9° | 109.5° |
P06 | O09 | P05 | 127.4° | 134.0° |
O09 | P06 | O11 | 113.5° | 109.5° |
O09 | P05 | O08 | 113.6° | 109.5° |
O09 | P05 | O14 | 113.1° | 109.5° |
O09 | P05 | O13 | 110.2° | 109.5° |
P06 | O11 | H13 | 109.5° | 114.0° |
O18 | P03 | O06 | 113.5° | 109.5° |
O18 | P03 | O07 | 110.8° | 109.5° |
P03 | O18 | H17 | 109.5° | 114.0° |
P05 | O08 | P04 | 123.4° | 134.0° |
O08 | P05 | O14 | 107.7° | 109.5° |
O08 | P05 | O13 | 109.0° | 109.4° |
O08 | P04 | O15 | 111.8° | 109.5° |
O08 | P04 | O07 | 108.3° | 109.5° |
O08 | P04 | O16 | 113.0° | 109.4° |
O06 | P03 | O07 | 108.6° | 109.5° |
P03 | O06 | P02 | 123.6° | 134.0° |
P03 | O07 | P04 | 120.6° | 134.0° |
O20 | P02 | O06 | 111.9° | 109.5° |
O20 | P02 | O05 | 111.1° | 109.5° |
P02 | O20 | H18 | 109.5° | 114.0° |
O06 | P02 | O05 | 111.5° | 109.5° |
P02 | O05 | P01 | 125.1° | 134.0° |
O15 | P04 | O07 | 110.0° | 109.5° |
O15 | P04 | O16 | 101.7° | 109.5° |
O14 | P05 | O13 | 102.6° | 109.5° |
P05 | O13 | H15 | 109.5° | 114.0° |
O07 | P04 | O16 | 111.8° | 109.5° |
P04 | O16 | H16 | 109.5° | 114.0° |
O05 | P01 | O04 | 109.3° | 109.5° |
O05 | P01 | O22 | 112.6° | 109.5° |
O05 | P01 | O21 | 111.3° | 109.4° |
O04 | P01 | O22 | 110.8° | 109.5° |
O04 | P01 | O21 | 112.2° | 109.5° |
P01 | O04 | C10 | 120.0° | 123.0° |
O22 | P01 | O21 | 100.5° | 109.5° |
P01 | O21 | H19 | 109.5° | 114.0° |
O04 | C10 | C09 | 110.9° | 109.5° |
O04 | C10 | H1 | 109.1° | 109.5° |
O04 | C10 | H2 | 109.1° | 109.5° |
C10 | C09 | O02 | 110.1° | 110.4° |
C10 | C09 | C01 | 107.8° | 110.4° |
C09 | C10 | H1 | 109.1° | 109.5° |
C09 | C10 | H2 | 109.1° | 109.5° |
C10 | C09 | H8 | 110.7° | 110.3° |
O02 | C09 | C01 | 106.0° | 104.8° |
C09 | O02 | C03 | 107.8° | 105.2° |
O02 | C09 | H8 | 111.3° | 110.4° |
C09 | C01 | O01 | 111.9° | 110.6° |
C09 | C01 | C02 | 104.2° | 104.1° |
C09 | C01 | H3 | 110.0° | 110.5° |
C01 | C09 | H8 | 110.8° | 110.5° |
O01 | C01 | C02 | 109.4° | 110.5° |
O01 | C01 | H3 | 110.9° | 110.5° |
C01 | O01 | H11 | 109.5° | 114.1° |
O02 | C03 | C02 | 106.4° | 104.9° |
O02 | C03 | N01 | 115.8° | 110.4° |
O02 | C03 | H5 | 109.7° | 110.4° |
C01 | C02 | C03 | 106.0° | 104.0° |
C01 | C02 | O03 | 111.1° | 110.6° |
C02 | C01 | H3 | 110.3° | 110.5° |
C01 | C02 | H4 | 109.3° | 110.5° |
C02 | C03 | N01 | 105.2° | 110.4° |
C03 | C02 | O03 | 111.7° | 110.5° |
C03 | C02 | H4 | 108.9° | 110.6° |
C02 | C03 | H5 | 109.2° | 110.4° |
C03 | N01 | C04 | 123.5° | 126.2° |
C03 | N01 | C06 | 122.3° | 126.3° |
N01 | C03 | H5 | 110.2° | 110.3° |
O03 | C02 | H4 | 109.8° | 110.5° |
C02 | O03 | H12 | 109.5° | 114.0° |
C04 | N01 | C06 | 114.2° | 107.5° |
N01 | C04 | N02 | 111.1° | 109.9° |
N01 | C04 | H6 | 124.5° | 125.0° |
N01 | C06 | N03 | 131.4° | 134.9° |
N01 | C06 | C05 | 102.8° | 106.0° |
C04 | N02 | C05 | 102.4° | 109.5° |
N02 | C04 | H6 | 124.5° | 125.0° |
N03 | C06 | C05 | 125.8° | 119.1° |
C06 | N03 | C07 | 111.3° | 120.6° |
C06 | C05 | N02 | 109.6° | 107.1° |
C06 | C05 | C08 | 115.9° | 118.2° |
N03 | C07 | N04 | 127.8° | 122.5° |
N03 | C07 | H7 | 116.1° | 118.8° |
N02 | C05 | C08 | 134.5° | 134.7° |
C05 | C08 | N04 | 121.0° | 118.5° |
C05 | C08 | N05 | 119.5° | 120.8° |
C07 | N04 | C08 | 118.2° | 121.2° |
N04 | C07 | H7 | 116.1° | 118.7° |
N04 | C08 | N05 | 119.5° | 120.8° |
C08 | N05 | H9 | 109.5° | 120.0° |
C08 | N05 | H10 | 109.4° | 120.0° |
H1 | C10 | H2 | 109.5° | 109.4° |
H9 | N05 | H10 | 109.4° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O10 | P06 | O12 | O09 | 125.7° | 120.1° |
O10 | P06 | O12 | O11 | 105.3° | 120.0° |
O10 | P06 | O09 | O11 | 113.3° | 120.0° |
O10 | P06 | O09 | P05 | 100.2° | 40.0° |
O10 | P06 | O11 | H13 | 0.0° | 179.9° |
O10 | P06 | O12 | H14 | 0.0° | 59.9° |
O12 | P06 | O09 | O11 | 125.4° | 120.0° |
O12 | P06 | O09 | P05 | 138.5° | 160.0° |
O12 | P06 | O11 | H13 | 107.7° | 60.0° |
O17 | P03 | O18 | O06 | 119.7° | 120.0° |
O17 | P03 | O18 | O07 | 117.8° | 120.0° |
O17 | P03 | O06 | O07 | 122.9° | 120.0° |
O17 | P03 | O06 | P02 | 55.2° | 45.0° |
O17 | P03 | O07 | P04 | 19.5° | 39.9° |
O17 | P03 | O18 | H17 | 0.0° | 180.0° |
O19 | P02 | O06 | P03 | 100.7° | 45.0° |
O19 | P02 | O20 | O06 | 115.7° | 120.0° |
O19 | P02 | O20 | O05 | 118.9° | 120.0° |
O19 | P02 | O06 | O05 | 123.9° | 120.0° |
O19 | P02 | O05 | P01 | 161.7° | 40.0° |
O19 | P02 | O20 | H18 | 0.0° | 180.0° |
P06 | O09 | P05 | O08 | 133.4° | 160.0° |
P06 | O09 | P05 | O14 | 103.3° | 40.0° |
P06 | O09 | P05 | O13 | 10.8° | 80.0° |
O09 | P06 | O11 | H13 | 120.5° | 60.0° |
O09 | P06 | O12 | H14 | 125.7° | 180.0° |
P05 | O09 | P06 | O11 | 13.1° | 80.0° |
O09 | P05 | O08 | O14 | 126.2° | 120.0° |
O09 | P05 | O08 | O13 | 123.2° | 120.0° |
O09 | P05 | O08 | P04 | 167.3° | 165.0° |
O09 | P05 | O14 | O13 | 118.6° | 120.0° |
O09 | P05 | O13 | H15 | 120.7° | 60.0° |
O11 | P06 | O12 | H14 | 105.3° | 60.0° |
O18 | P03 | O06 | O07 | 123.8° | 120.0° |
O18 | P03 | O06 | P02 | 168.5° | 75.0° |
O18 | P03 | O07 | P04 | 91.8° | 80.1° |
P05 | O08 | P04 | O15 | 147.8° | 40.0° |
O08 | P05 | O14 | O13 | 114.9° | 120.0° |
P05 | O08 | P04 | O07 | 90.8° | 160.0° |
P05 | O08 | P04 | O16 | 33.7° | 80.0° |
O08 | P05 | O13 | H15 | 114.0° | 60.0° |
O08 | P04 | O07 | P03 | 62.4° | 165.0° |
O08 | P04 | O15 | O07 | 120.4° | 120.0° |
O08 | P04 | O15 | O16 | 120.9° | 120.0° |
P04 | O08 | P05 | O14 | 66.6° | 44.9° |
P04 | O08 | P05 | O13 | 44.0° | 75.1° |
O08 | P04 | O07 | O16 | 125.2° | 119.9° |
O08 | P04 | O16 | H16 | 120.1° | 60.0° |
P03 | O06 | P02 | O20 | 10.3° | 75.0° |
P03 | O06 | P02 | O05 | 135.4° | 165.0° |
O06 | P03 | O07 | P04 | 142.8° | 160.0° |
O06 | P03 | O18 | H17 | 119.7° | 60.0° |
O07 | P03 | O06 | P02 | 67.7° | 165.0° |
P03 | O07 | P04 | O15 | 60.1° | 44.9° |
P03 | O07 | P04 | O16 | 172.4° | 75.1° |
O07 | P03 | O18 | H17 | 117.7° | 60.0° |
O20 | P02 | O06 | O05 | 125.1° | 120.0° |
O20 | P02 | O05 | P01 | 86.0° | 80.0° |
O06 | P02 | O05 | P01 | 39.6° | 160.0° |
O06 | P02 | O20 | H18 | 115.7° | 60.0° |
P02 | O05 | P01 | O04 | 20.3° | 165.0° |
P02 | O05 | P01 | O22 | 103.2° | 45.0° |
P02 | O05 | P01 | O21 | 144.8° | 75.0° |
O05 | P02 | O20 | H18 | 119.0° | 60.0° |
O15 | P04 | O07 | O16 | 112.3° | 120.0° |
O15 | P04 | O16 | H16 | 0.0° | 180.0° |
O14 | P05 | O13 | H15 | 0.0° | 180.0° |
O07 | P04 | O16 | H16 | 117.4° | 60.0° |
O05 | P01 | O04 | O22 | 124.6° | 120.0° |
O05 | P01 | O04 | O21 | 124.0° | 120.0° |
O05 | P01 | O22 | O21 | 118.5° | 120.0° |
O05 | P01 | O04 | C10 | 164.5° | 175.0° |
O05 | P01 | O21 | H19 | 119.4° | 60.0° |
O04 | P01 | O22 | O21 | 118.7° | 120.0° |
P01 | O04 | C10 | C09 | 152.0° | 180.0° |
P01 | O04 | C10 | H1 | 87.8° | 60.0° |
P01 | O04 | C10 | H2 | 31.8° | 60.0° |
O04 | P01 | O21 | H19 | 117.7° | 60.0° |
O22 | P01 | O04 | C10 | 39.9° | 55.0° |
O22 | P01 | O21 | H19 | 0.0° | 180.0° |
O21 | P01 | O04 | C10 | 71.5° | 65.0° |
O04 | C10 | C09 | H1 | 120.2° | 120.0° |
O04 | C10 | C09 | H2 | 120.2° | 120.0° |
O04 | C10 | C09 | O02 | 93.9° | 66.4° |
O04 | C10 | C09 | C01 | 151.0° | 178.2° |
O04 | C10 | H1 | H2 | 119.4° | 120.0° |
O04 | C10 | C09 | H8 | 29.6° | 55.8° |
C10 | C09 | O02 | C01 | 116.3° | 118.8° |
C10 | C09 | O02 | H8 | 123.1° | 122.2° |
C10 | C09 | C01 | H8 | 121.3° | 122.3° |
C10 | C09 | C01 | O01 | 154.8° | 98.5° |
C10 | C09 | O02 | C03 | 95.8° | 159.3° |
C10 | C09 | C01 | C02 | 87.2° | 142.8° |
C09 | C10 | H1 | H2 | 119.4° | 120.0° |
C10 | C09 | C01 | H3 | 31.1° | 24.2° |
O02 | C09 | C01 | H8 | 120.9° | 118.9° |
O02 | C09 | C01 | O01 | 87.4° | 142.6° |
O02 | C09 | C01 | C02 | 30.7° | 24.0° |
C09 | O02 | C03 | C02 | 2.5° | 40.5° |
C09 | O02 | C03 | N01 | 114.0° | 159.3° |
O02 | C09 | C10 | H1 | 26.4° | 173.5° |
O02 | C09 | C10 | H2 | 145.9° | 53.6° |
O02 | C09 | C01 | H3 | 148.9° | 94.7° |
C09 | O02 | C03 | H5 | 120.5° | 78.4° |
C09 | C01 | O01 | C02 | 114.9° | 114.7° |
C09 | C01 | O01 | H3 | 123.3° | 122.7° |
C01 | C09 | O02 | C03 | 20.5° | 40.5° |
C09 | C01 | C02 | H3 | 118.1° | 118.7° |
C09 | C01 | C02 | C03 | 29.0° | 0.1° |
C09 | C01 | C02 | O03 | 150.5° | 118.6° |
C01 | C09 | C10 | H1 | 88.8° | 58.1° |
C01 | C09 | C10 | H2 | 30.8° | 61.8° |
C09 | C01 | C02 | H4 | 88.2° | 118.7° |
C09 | C01 | O01 | H11 | 180.0° | 176.2° |
O01 | C01 | C02 | H3 | 122.2° | 122.5° |
O01 | C01 | C02 | C03 | 90.8° | 118.8° |
O01 | C01 | C02 | O03 | 30.8° | 0.2° |
O01 | C01 | C02 | H4 | 152.0° | 122.5° |
O01 | C01 | C09 | H8 | 33.5° | 23.8° |
O02 | C03 | C02 | C01 | 16.8° | 23.9° |
O02 | C03 | C02 | N01 | 123.4° | 118.9° |
O02 | C03 | C02 | H5 | 118.3° | 118.9° |
O02 | C03 | N01 | H5 | 125.2° | 122.3° |
O02 | C03 | C02 | O03 | 137.9° | 142.6° |
O02 | C03 | N01 | C04 | 52.9° | 20.4° |
O02 | C03 | N01 | C06 | 130.7° | 159.6° |
O02 | C03 | C02 | H4 | 100.7° | 94.7° |
C03 | O02 | C09 | H8 | 141.1° | 78.5° |
C01 | C02 | C03 | O03 | 121.1° | 118.7° |
C01 | C02 | C03 | H4 | 117.5° | 118.6° |
C01 | C02 | C03 | N01 | 140.2° | 142.8° |
C01 | C02 | O03 | H4 | 120.9° | 122.6° |
C01 | C02 | C03 | H5 | 101.5° | 95.0° |
C02 | C01 | C09 | H8 | 151.6° | 94.9° |
C02 | C01 | O01 | H11 | 65.1° | 61.5° |
C01 | C02 | O03 | H12 | 180.0° | 61.4° |
C02 | C03 | N01 | H5 | 117.6° | 122.2° |
C03 | C02 | O03 | H4 | 120.9° | 122.7° |
C02 | C03 | N01 | C04 | 64.4° | 95.0° |
C02 | C03 | N01 | C06 | 112.1° | 85.0° |
C03 | C02 | C01 | H3 | 147.0° | 118.6° |
C03 | C02 | O03 | H12 | 61.8° | 176.1° |
N01 | C03 | C02 | O03 | 98.6° | 98.5° |
C03 | N01 | C04 | C06 | 176.7° | 180.0° |
C03 | N01 | C04 | N02 | 178.3° | 180.0° |
C03 | N01 | C06 | N03 | 3.2° | 0.3° |
C03 | N01 | C06 | C05 | 178.1° | 179.8° |
N01 | C03 | C02 | H4 | 22.8° | 24.2° |
C03 | N01 | C04 | H6 | 1.7° | 0.2° |
O03 | C02 | C01 | H3 | 91.4° | 122.7° |
O03 | C02 | C03 | H5 | 19.6° | 23.7° |
N01 | C04 | N02 | H6 | 180.0° | 179.8° |
C04 | N01 | C06 | N03 | 180.0° | 179.7° |
C04 | N01 | C06 | C05 | 1.3° | 0.3° |
N01 | C04 | N02 | C05 | 1.0° | 0.2° |
C04 | N01 | C03 | H5 | 178.1° | 142.7° |
C06 | N01 | C04 | N02 | 1.6° | 0.0° |
N01 | C06 | N03 | C05 | 178.4° | 180.0° |
N01 | C06 | N03 | C07 | 179.3° | 180.0° |
N01 | C06 | C05 | N02 | 0.7° | 0.4° |
N01 | C06 | C05 | C08 | 179.8° | 180.0° |
C06 | N01 | C03 | H5 | 5.5° | 37.3° |
C06 | N01 | C04 | H6 | 178.4° | 179.8° |
C04 | N02 | C05 | C06 | 0.2° | 0.4° |
C04 | N02 | C05 | C08 | 179.3° | 179.9° |
N03 | C06 | C05 | N02 | 179.5° | 179.6° |
N03 | C06 | C05 | C08 | 1.0° | 0.0° |
C06 | N03 | C07 | N04 | 0.1° | 0.1° |
C06 | N03 | C07 | H7 | 179.9° | 180.0° |
C05 | C06 | N03 | C07 | 0.9° | 0.1° |
C06 | C05 | N02 | C08 | 179.4° | 179.6° |
C06 | C05 | C08 | N04 | 0.3° | 0.0° |
C06 | C05 | C08 | N05 | 179.9° | 180.0° |
N03 | C07 | N04 | H7 | 180.0° | 179.9° |
N03 | C07 | N04 | C08 | 0.5° | 0.1° |
N02 | C05 | C08 | N04 | 179.7° | 179.5° |
N02 | C05 | C08 | N05 | 0.7° | 0.5° |
C05 | N02 | C04 | H6 | 179.0° | 180.0° |
C05 | C08 | N04 | C07 | 0.3° | 0.1° |
C05 | C08 | N04 | N05 | 179.6° | 180.0° |
C05 | C08 | N05 | H9 | 179.6° | 0.0° |
C05 | C08 | N05 | H10 | 59.6° | 180.0° |
C07 | N04 | C08 | N05 | 179.3° | 179.9° |
C08 | N04 | C07 | H7 | 179.5° | 180.0° |
N04 | C08 | N05 | H9 | 0.0° | 179.9° |
N04 | C08 | N05 | H10 | 120.0° | 0.0° |
C08 | N05 | H9 | H10 | 120.0° | 179.9° |
H1 | C10 | C09 | H8 | 149.9° | 64.2° |
H2 | C10 | C09 | H8 | 90.6° | 175.8° |
H3 | C01 | C02 | H4 | 29.8° | 0.0° |
H3 | C01 | C09 | H8 | 90.2° | 146.4° |
H3 | C01 | O01 | H11 | 56.7° | 61.1° |
H4 | C02 | C03 | H5 | 141.0° | 146.4° |
H4 | C02 | O03 | H12 | 59.1° | 61.2° |