CZO
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
N1 | CA1 | sing | 1.47Å | 1.49Å | |
CA1 | CB1 | sing | 1.53Å | 1.51Å | |
CA1 | C1 | sing | 1.53Å | 1.56Å | |
CB1 | CG1 | sing | 1.53Å | 1.60Å | |
CB1 | OG1 | sing | 1.43Å | 1.45Å | |
C1 | N2 | sing | 1.48Å | 1.43Å | |
C1 | N3 | sing | 1.47Å | 1.52Å | |
C1 | O1 | sing | 1.43Å | 1.23Å | |
N2 | CA2 | sing | 1.48Å | 1.47Å | |
N3 | C2 | sing | 1.35Å | 1.53Å | |
N3 | CA3 | sing | 1.46Å | 1.48Å | |
C2 | O2 | doub | 1.21Å | 1.19Å | |
C2 | CA2 | sing | 1.51Å | 1.41Å | |
CA2 | CB2 | sing | 1.53Å | 1.44Å | |
CA3 | C3 | sing | 1.51Å | 1.58Å | |
C3 | O3 | doub | 1.21Å | 1.25Å | |
C3 | OXT | sing | 1.34Å | 1.39Å | |
CB2 | CG2 | sing | 1.51Å | 1.44Å | |
CG2 | CD1 | doub | 1.38Å | 1.41Å | Aromatic |
CG2 | CD2 | sing | 1.38Å | 1.41Å | Aromatic |
CD1 | CE1 | sing | 1.38Å | 1.42Å | Aromatic |
CD2 | CE2 | doub | 1.38Å | 1.42Å | Aromatic |
CE1 | CZ | doub | 1.39Å | 1.40Å | Aromatic |
CE2 | CZ | sing | 1.39Å | 1.39Å | Aromatic |
CZ | OH | sing | 1.36Å | 1.36Å | |
N1 | H | sing | 1.01Å | 1.00Å | |
N1 | H2 | sing | 1.01Å | 1.00Å | |
CA1 | HA1 | sing | 1.09Å | 1.10Å | |
CB1 | HB1 | sing | 1.09Å | 1.10Å | |
CG1 | HG1 | sing | 1.09Å | 1.10Å | |
CG1 | HG1A | sing | 1.09Å | 1.10Å | |
CG1 | HG1B | sing | 1.09Å | 1.10Å | |
OG1 | HOG1 | sing | 0.97Å | 0.95Å | |
N2 | HN2 | sing | 1.01Å | 1.00Å | |
CA2 | HA2 | sing | 1.09Å | 1.10Å | |
CA3 | HA31 | sing | 1.09Å | 1.10Å | |
CA3 | HA32 | sing | 1.09Å | 1.10Å | |
CB2 | HB2 | sing | 1.09Å | 1.10Å | |
CB2 | HB2A | sing | 1.09Å | 1.10Å | |
CD1 | HD1 | sing | 1.08Å | 1.08Å | |
CD2 | HD2 | sing | 1.08Å | 1.08Å | |
CE1 | HE1 | sing | 1.08Å | 1.08Å | |
CE2 | HE2 | sing | 1.08Å | 1.08Å | |
OH | HOH | sing | 0.97Å | 0.95Å | |
OXT | HXT | sing | 0.97Å | 0.95Å | |
O1 | HO1 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N1 | CA1 | CB1 | 120.5° | 109.5° |
N1 | CA1 | C1 | 118.9° | 109.4° |
CA1 | N1 | H | 109.5° | 111.0° |
CA1 | N1 | H2 | 109.4° | 111.1° |
N1 | CA1 | HA1 | 90.9° | 109.5° |
CB1 | CA1 | C1 | 109.3° | 109.4° |
CA1 | CB1 | CG1 | 104.1° | 109.4° |
CA1 | CB1 | OG1 | 109.1° | 109.5° |
CB1 | CA1 | HA1 | 105.7° | 109.5° |
CA1 | CB1 | HB1 | 110.8° | 109.5° |
CA1 | C1 | N2 | 89.6° | 110.1° |
CA1 | C1 | N3 | 133.8° | 110.2° |
CA1 | C1 | O1 | 113.6° | 110.1° |
C1 | CA1 | HA1 | 108.2° | 109.4° |
CG1 | CB1 | OG1 | 101.6° | 109.5° |
CG1 | CB1 | HB1 | 117.4° | 109.5° |
CB1 | CG1 | HG1 | 109.5° | 109.4° |
CB1 | CG1 | HG1A | 109.5° | 109.5° |
CB1 | CG1 | HG1B | 109.4° | 109.5° |
OG1 | CB1 | HB1 | 113.0° | 109.5° |
CB1 | OG1 | HOG1 | 109.5° | 114.0° |
N2 | C1 | N3 | 90.5° | 106.2° |
N2 | C1 | O1 | 124.8° | 110.1° |
C1 | N2 | CA2 | 106.9° | 103.2° |
C1 | N2 | HN2 | 110.3° | 111.0° |
N3 | C1 | O1 | 103.9° | 110.1° |
C1 | N3 | C2 | 106.1° | 109.6° |
C1 | N3 | CA3 | 147.5° | 125.2° |
C1 | O1 | HO1 | 109.5° | 114.0° |
N2 | CA2 | C2 | 101.2° | 104.8° |
N2 | CA2 | CB2 | 120.2° | 110.4° |
CA2 | N2 | HN2 | 110.3° | 111.0° |
N2 | CA2 | HA2 | 106.9° | 110.4° |
C2 | N3 | CA3 | 103.1° | 125.2° |
N3 | C2 | O2 | 122.6° | 125.8° |
N3 | C2 | CA2 | 103.7° | 108.5° |
N3 | CA3 | C3 | 114.1° | 109.4° |
N3 | CA3 | HA31 | 108.0° | 109.5° |
N3 | CA3 | HA32 | 106.9° | 109.5° |
O2 | C2 | CA2 | 133.5° | 125.7° |
C2 | CA2 | CB2 | 105.1° | 110.4° |
C2 | CA2 | HA2 | 121.6° | 110.4° |
CA2 | CB2 | CG2 | 105.6° | 109.5° |
CB2 | CA2 | HA2 | 103.0° | 110.4° |
CA2 | CB2 | HB2 | 110.8° | 109.5° |
CA2 | CB2 | HB2A | 111.6° | 109.5° |
CA3 | C3 | O3 | 127.3° | 120.0° |
CA3 | C3 | OXT | 116.1° | 120.0° |
C3 | CA3 | HA31 | 108.0° | 109.5° |
C3 | CA3 | HA32 | 106.9° | 109.4° |
O3 | C3 | OXT | 116.6° | 120.0° |
C3 | OXT | HXT | 109.5° | 117.0° |
CB2 | CG2 | CD1 | 120.9° | 119.9° |
CB2 | CG2 | CD2 | 119.8° | 119.9° |
CG2 | CB2 | HB2 | 110.8° | 109.5° |
CG2 | CB2 | HB2A | 111.6° | 109.5° |
CD1 | CG2 | CD2 | 119.3° | 120.1° |
CG2 | CD1 | CE1 | 124.1° | 120.1° |
CG2 | CD1 | HD1 | 117.9° | 120.0° |
CG2 | CD2 | CE2 | 115.6° | 120.0° |
CG2 | CD2 | HD2 | 122.2° | 120.0° |
CD1 | CE1 | CZ | 116.8° | 119.9° |
CE1 | CD1 | HD1 | 117.9° | 120.0° |
CD1 | CE1 | HE1 | 121.6° | 120.0° |
CD2 | CE2 | CZ | 125.4° | 119.9° |
CE2 | CD2 | HD2 | 122.2° | 120.0° |
CD2 | CE2 | HE2 | 117.3° | 120.0° |
CE1 | CZ | CE2 | 118.8° | 119.9° |
CE1 | CZ | OH | 117.8° | 120.0° |
CZ | CE1 | HE1 | 121.6° | 120.1° |
CE2 | CZ | OH | 123.4° | 120.0° |
CZ | CE2 | HE2 | 117.3° | 120.1° |
CZ | OH | HOH | 109.5° | 114.0° |
H | N1 | H2 | 109.5° | 111.0° |
HG1 | CG1 | HG1A | 109.5° | 109.5° |
HG1 | CG1 | HG1B | 109.4° | 109.5° |
HG1A | CG1 | HG1B | 109.5° | 109.5° |
HA31 | CA3 | HA32 | 113.1° | 109.5° |
HB2 | CB2 | HB2A | 106.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N1 | CA1 | CB1 | C1 | 143.2° | 119.9° |
N1 | CA1 | CB1 | HA1 | 100.6° | 120.1° |
N1 | CA1 | C1 | HA1 | 101.5° | 120.0° |
N1 | CA1 | CB1 | CG1 | 46.7° | 55.1° |
N1 | CA1 | CB1 | OG1 | 61.2° | 65.0° |
N1 | CA1 | C1 | N2 | 72.8° | 58.6° |
N1 | CA1 | C1 | N3 | 17.4° | 58.2° |
N1 | CA1 | C1 | O1 | 158.9° | 179.8° |
CA1 | N1 | H | H2 | 120.0° | 124.0° |
N1 | CA1 | CB1 | HB1 | 173.8° | 175.0° |
CB1 | CA1 | C1 | HA1 | 114.6° | 120.0° |
CA1 | CB1 | CG1 | OG1 | 113.4° | 120.0° |
CA1 | CB1 | CG1 | HB1 | 122.9° | 120.0° |
CA1 | CB1 | OG1 | HB1 | 123.7° | 120.0° |
CB1 | CA1 | C1 | N2 | 71.0° | 61.4° |
CB1 | CA1 | C1 | N3 | 161.2° | 178.2° |
CB1 | CA1 | C1 | O1 | 57.3° | 60.2° |
CB1 | CA1 | N1 | H | 140.5° | 176.1° |
CB1 | CA1 | N1 | H2 | 20.5° | 59.9° |
CA1 | CB1 | CG1 | HG1 | 169.8° | 180.0° |
CA1 | CB1 | CG1 | HG1A | 70.2° | 60.0° |
CA1 | CB1 | CG1 | HG1B | 49.8° | 60.0° |
CA1 | CB1 | OG1 | HOG1 | 46.4° | 179.9° |
C1 | CA1 | CB1 | CG1 | 170.1° | 175.0° |
C1 | CA1 | CB1 | OG1 | 82.0° | 55.0° |
CA1 | C1 | N2 | N3 | 133.8° | 119.2° |
CA1 | C1 | N2 | O1 | 118.9° | 121.6° |
CA1 | C1 | N3 | O1 | 144.0° | 121.6° |
CA1 | C1 | N2 | CA2 | 170.9° | 146.2° |
CA1 | C1 | N3 | C2 | 132.3° | 136.7° |
CA1 | C1 | N3 | CA3 | 74.7° | 43.1° |
C1 | CA1 | N1 | H | 0.8° | 64.0° |
C1 | CA1 | N1 | H2 | 119.2° | 60.0° |
C1 | CA1 | CB1 | HB1 | 43.0° | 65.0° |
CA1 | C1 | N2 | HN2 | 50.9° | 94.8° |
CA1 | C1 | O1 | HO1 | 12.1° | 180.0° |
CG1 | CB1 | OG1 | HB1 | 126.7° | 120.0° |
CG1 | CB1 | CA1 | HA1 | 53.9° | 65.0° |
CB1 | CG1 | HG1 | HG1A | 120.0° | 120.0° |
CB1 | CG1 | HG1 | HG1B | 120.0° | 120.0° |
CB1 | CG1 | HG1A | HG1B | 120.0° | 120.0° |
CG1 | CB1 | OG1 | HOG1 | 156.0° | 60.0° |
OG1 | CB1 | CA1 | HA1 | 161.8° | 174.9° |
OG1 | CB1 | CG1 | HG1 | 56.4° | 60.0° |
OG1 | CB1 | CG1 | HG1A | 176.5° | 179.9° |
OG1 | CB1 | CG1 | HG1B | 63.5° | 60.0° |
N2 | C1 | N3 | O1 | 126.2° | 119.2° |
C1 | N2 | CA2 | HN2 | 120.0° | 119.0° |
N2 | C1 | N3 | C2 | 42.5° | 17.5° |
N2 | C1 | N3 | CA3 | 164.5° | 162.3° |
C1 | N2 | CA2 | C2 | 49.0° | 26.3° |
C1 | N2 | CA2 | CB2 | 164.1° | 145.1° |
N2 | C1 | CA1 | HA1 | 174.4° | 178.6° |
C1 | N2 | CA2 | HA2 | 79.2° | 92.5° |
N2 | C1 | O1 | HO1 | 95.0° | 58.4° |
N3 | C1 | N2 | CA2 | 55.3° | 27.0° |
C1 | N3 | C2 | CA3 | 165.5° | 179.8° |
C1 | N3 | C2 | O2 | 167.5° | 179.6° |
C1 | N3 | C2 | CA2 | 17.3° | 0.4° |
C1 | N3 | CA3 | C3 | 50.2° | 90.0° |
N3 | C1 | CA1 | HA1 | 84.1° | 61.8° |
N3 | C1 | N2 | HN2 | 175.3° | 146.0° |
C1 | N3 | CA3 | HA31 | 170.2° | 150.0° |
C1 | N3 | CA3 | HA32 | 67.8° | 29.9° |
N3 | C1 | O1 | HO1 | 164.5° | 58.4° |
O1 | C1 | N2 | CA2 | 52.1° | 92.2° |
O1 | C1 | N3 | C2 | 83.7° | 101.7° |
O1 | C1 | N3 | CA3 | 69.3° | 78.5° |
O1 | C1 | CA1 | HA1 | 57.3° | 59.8° |
O1 | C1 | N2 | HN2 | 67.9° | 26.8° |
N2 | CA2 | C2 | N3 | 16.0° | 16.8° |
N2 | CA2 | C2 | O2 | 158.4° | 163.3° |
N2 | CA2 | C2 | CB2 | 125.8° | 118.8° |
N2 | CA2 | C2 | HA2 | 118.0° | 118.8° |
N2 | CA2 | CB2 | HA2 | 118.7° | 122.3° |
N2 | CA2 | CB2 | CG2 | 78.8° | 65.0° |
N2 | CA2 | CB2 | HB2 | 41.2° | 55.0° |
N2 | CA2 | CB2 | HB2A | 159.8° | 175.0° |
N3 | C2 | O2 | CA2 | 173.5° | 179.9° |
N3 | C2 | CA2 | CB2 | 141.8° | 135.6° |
C2 | N3 | CA3 | C3 | 103.2° | 90.1° |
N3 | C2 | CA2 | HA2 | 102.0° | 102.0° |
C2 | N3 | CA3 | HA31 | 16.8° | 29.9° |
C2 | N3 | CA3 | HA32 | 138.8° | 149.9° |
CA3 | N3 | C2 | O2 | 2.1° | 0.6° |
CA3 | N3 | C2 | CA2 | 177.2° | 179.5° |
N3 | CA3 | C3 | HA31 | 120.0° | 120.0° |
N3 | CA3 | C3 | HA32 | 118.0° | 120.0° |
N3 | CA3 | C3 | O3 | 172.8° | 0.0° |
N3 | CA3 | C3 | OXT | 7.3° | 180.0° |
N3 | CA3 | HA31 | HA32 | 118.1° | 120.1° |
O2 | C2 | CA2 | CB2 | 32.5° | 44.4° |
O2 | C2 | CA2 | HA2 | 83.6° | 77.9° |
C2 | CA2 | CB2 | HA2 | 128.3° | 122.3° |
C2 | CA2 | CB2 | CG2 | 168.2° | 179.7° |
C2 | CA2 | N2 | HN2 | 169.0° | 145.3° |
C2 | CA2 | CB2 | HB2 | 71.8° | 60.3° |
C2 | CA2 | CB2 | HB2A | 46.7° | 59.7° |
CA2 | CB2 | CG2 | HB2 | 120.0° | 120.0° |
CA2 | CB2 | CG2 | HB2A | 121.5° | 120.0° |
CA2 | CB2 | CG2 | CD1 | 62.7° | 90.0° |
CA2 | CB2 | CG2 | CD2 | 117.3° | 90.3° |
CB2 | CA2 | N2 | HN2 | 75.9° | 95.9° |
CA2 | CB2 | HB2 | HB2A | 121.6° | 120.0° |
CA3 | C3 | O3 | OXT | 179.9° | 180.0° |
C3 | CA3 | HA31 | HA32 | 118.1° | 119.9° |
CA3 | C3 | OXT | HXT | 180.0° | 180.0° |
O3 | C3 | CA3 | HA31 | 52.8° | 120.0° |
O3 | C3 | CA3 | HA32 | 69.3° | 120.0° |
O3 | C3 | OXT | HXT | 0.0° | 0.1° |
OXT | C3 | CA3 | HA31 | 127.3° | 60.0° |
OXT | C3 | CA3 | HA32 | 110.7° | 60.0° |
CB2 | CG2 | CD1 | CD2 | 180.0° | 179.8° |
CB2 | CG2 | CD1 | CE1 | 180.0° | 180.0° |
CB2 | CG2 | CD2 | CE2 | 179.9° | 180.0° |
CG2 | CB2 | CA2 | HA2 | 40.0° | 57.4° |
CG2 | CB2 | HB2 | HB2A | 121.6° | 120.0° |
CB2 | CG2 | CD1 | HD1 | 0.0° | 0.0° |
CB2 | CG2 | CD2 | HD2 | 0.1° | 0.0° |
CG2 | CD1 | CE1 | HD1 | 180.0° | 180.0° |
CD1 | CG2 | CD2 | CE2 | 0.1° | 0.2° |
CG2 | CD1 | CE1 | CZ | 0.1° | 0.0° |
CD1 | CG2 | CB2 | HB2 | 57.3° | 30.0° |
CD1 | CG2 | CB2 | HB2A | 175.8° | 150.0° |
CD1 | CG2 | CD2 | HD2 | 179.9° | 179.7° |
CG2 | CD1 | CE1 | HE1 | 179.9° | 180.0° |
CD2 | CG2 | CD1 | CE1 | 0.0° | 0.3° |
CG2 | CD2 | CE2 | HD2 | 180.0° | 180.0° |
CG2 | CD2 | CE2 | CZ | 0.2° | 0.0° |
CD2 | CG2 | CB2 | HB2 | 122.7° | 149.7° |
CD2 | CG2 | CB2 | HB2A | 4.1° | 29.7° |
CD2 | CG2 | CD1 | HD1 | 180.0° | 179.8° |
CG2 | CD2 | CE2 | HE2 | 179.8° | 179.9° |
CD1 | CE1 | CZ | HE1 | 180.0° | 180.0° |
CD1 | CE1 | CZ | CE2 | 0.1° | 0.2° |
CD1 | CE1 | CZ | OH | 179.9° | 180.0° |
CD2 | CE2 | CZ | CE1 | 0.2° | 0.3° |
CD2 | CE2 | CZ | HE2 | 180.0° | 179.9° |
CD2 | CE2 | CZ | OH | 180.0° | 180.0° |
CE1 | CZ | CE2 | OH | 179.8° | 179.8° |
CZ | CE1 | CD1 | HD1 | 180.0° | 180.0° |
CE1 | CZ | CE2 | HE2 | 179.8° | 179.7° |
CE1 | CZ | OH | HOH | 176.4° | 90.0° |
CZ | CE2 | CD2 | HD2 | 179.8° | 180.0° |
CE2 | CZ | CE1 | HE1 | 179.9° | 179.8° |
CE2 | CZ | OH | HOH | 3.8° | 89.7° |
OH | CZ | CE1 | HE1 | 0.1° | 0.0° |
OH | CZ | CE2 | HE2 | 0.0° | 0.1° |
H | N1 | CA1 | HA1 | 110.6° | 56.0° |
H2 | N1 | CA1 | HA1 | 129.4° | 180.0° |
HA1 | CA1 | CB1 | HB1 | 73.2° | 54.9° |
HB1 | CB1 | CG1 | HG1 | 67.3° | 60.0° |
HB1 | CB1 | CG1 | HG1A | 52.7° | 59.9° |
HB1 | CB1 | CG1 | HG1B | 172.7° | 180.0° |
HB1 | CB1 | OG1 | HOG1 | 77.4° | 60.0° |
HG1 | CG1 | HG1A | HG1B | 120.0° | 120.0° |
HN2 | N2 | CA2 | HA2 | 40.8° | 26.5° |
HA2 | CA2 | CB2 | HB2 | 160.0° | 177.3° |
HA2 | CA2 | CB2 | HB2A | 81.5° | 62.6° |
HD1 | CD1 | CE1 | HE1 | 0.1° | 0.0° |
HD2 | CD2 | CE2 | HE2 | 0.2° | 0.1° |