6DN
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O2 | CX2 | doub | 0.00Å | 1.24Å | |
NZ | CE | sing | 0.00Å | 1.48Å | |
NZ | CX1 | sing | 0.00Å | 1.46Å | |
CX2 | O1 | sing | 0.00Å | 1.27Å | |
CX2 | CX1 | sing | 0.00Å | 1.52Å | |
CE | CD | sing | 0.00Å | 1.53Å | |
CD | CG | sing | 0.00Å | 1.55Å | |
CG | CB | sing | 0.00Å | 1.55Å | |
CB | CA | sing | 0.00Å | 1.53Å | |
CA | C | sing | 0.00Å | 1.50Å | |
CA | N | sing | 0.00Å | 1.46Å | |
C | O | doub | 0.00Å | 1.25Å | |
C | OXT | sing | 0.00Å | 1.33Å | |
O1 | H1 | sing | 0.00Å | 0.95Å | |
CB | HB2 | sing | 0.00Å | 1.10Å | |
CB | HB3 | sing | 0.00Å | 1.10Å | |
CA | HA | sing | 0.00Å | 1.10Å | |
N | H | sing | 0.00Å | 1.00Å | |
N | H2 | sing | 0.00Å | 1.00Å | |
CG | HG2 | sing | 0.00Å | 1.10Å | |
CG | HG3 | sing | 0.00Å | 1.10Å | |
CD | HD2 | sing | 0.00Å | 1.10Å | |
CD | HD3 | sing | 0.00Å | 1.10Å | |
CE | HE2 | sing | 0.00Å | 1.10Å | |
CE | HE3 | sing | 0.00Å | 1.10Å | |
NZ | HZ1 | sing | 0.00Å | 1.00Å | |
CX1 | H16 | sing | 0.00Å | 1.10Å | |
CX1 | H17 | sing | 0.00Å | 1.10Å | |
OXT | HXT | sing | 0.00Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O2 | CX2 | O1 | 122.1° | 90.0° |
O2 | CX2 | CX1 | 118.3° | 90.0° |
CE | NZ | CX1 | 123.8° | 90.0° |
NZ | CE | CD | 118.0° | 90.0° |
NZ | CE | HE2 | 107.3° | 90.0° |
NZ | CE | HE3 | 107.3° | 90.0° |
CE | NZ | HZ1 | 105.8° | 90.0° |
NZ | CX1 | CX2 | 117.4° | 90.0° |
CX1 | NZ | HZ1 | 105.8° | 90.0° |
NZ | CX1 | H16 | 107.4° | 90.0° |
NZ | CX1 | H17 | 107.4° | 90.0° |
O1 | CX2 | CX1 | 119.6° | 90.0° |
CX2 | O1 | H1 | 109.5° | 90.0° |
CX2 | CX1 | H16 | 107.5° | 90.0° |
CX2 | CX1 | H17 | 107.5° | 90.0° |
CE | CD | CG | 113.8° | 90.0° |
CE | CD | HD2 | 108.4° | 90.0° |
CE | CD | HD3 | 108.4° | 90.0° |
CD | CE | HE2 | 107.3° | 90.0° |
CD | CE | HE3 | 107.3° | 90.0° |
CD | CG | CB | 112.5° | 90.0° |
CD | CG | HG2 | 108.7° | 90.0° |
CD | CG | HG3 | 108.7° | 90.0° |
CG | CD | HD2 | 108.4° | 90.0° |
CG | CD | HD3 | 108.4° | 90.0° |
CG | CB | CA | 116.9° | 90.0° |
CG | CB | HB2 | 107.6° | 90.0° |
CG | CB | HB3 | 107.6° | 90.0° |
CB | CG | HG2 | 108.7° | 90.0° |
CB | CG | HG3 | 108.7° | 90.0° |
CB | CA | C | 110.0° | 90.0° |
CB | CA | N | 111.9° | 90.0° |
CA | CB | HB2 | 107.6° | 90.0° |
CA | CB | HB3 | 107.6° | 90.0° |
CB | CA | HA | 110.5° | 90.0° |
C | CA | N | 101.8° | 90.0° |
CA | C | O | 119.3° | 90.0° |
CA | C | OXT | 116.4° | 90.0° |
C | CA | HA | 110.9° | 90.0° |
N | CA | HA | 111.5° | 90.0° |
CA | N | H | 109.5° | 90.0° |
CA | N | H2 | 109.5° | 90.0° |
O | C | OXT | 124.1° | 90.0° |
C | OXT | HXT | 109.5° | 90.0° |
HB2 | CB | HB3 | 109.4° | 90.0° |
H | N | H2 | 109.5° | 90.0° |
HG2 | CG | HG3 | 109.5° | 90.0° |
HD2 | CD | HD3 | 109.5° | 90.0° |
HE2 | CE | HE3 | 109.5° | 90.0° |
H16 | CX1 | H17 | 109.5° | 90.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O2 | CX2 | CX1 | NZ | 48.7° | 90.0° |
O2 | CX2 | O1 | CX1 | 179.5° | 90.0° |
O2 | CX2 | O1 | H1 | 0.0° | 90.0° |
O2 | CX2 | CX1 | H16 | 72.5° | 90.0° |
O2 | CX2 | CX1 | H17 | 169.8° | 90.0° |
CE | NZ | CX1 | HZ1 | 121.9° | 90.0° |
CE | NZ | CX1 | CX2 | 158.8° | 90.0° |
NZ | CE | CD | HE2 | 121.2° | 90.0° |
NZ | CE | CD | HE3 | 121.2° | 90.0° |
NZ | CE | CD | CG | 152.8° | 90.0° |
NZ | CE | CD | HD2 | 86.5° | 90.0° |
NZ | CE | CD | HD3 | 32.2° | 90.0° |
NZ | CE | HE2 | HE3 | 116.1° | 90.0° |
CE | NZ | CX1 | H16 | 37.7° | 90.0° |
CE | NZ | CX1 | H17 | 80.0° | 90.0° |
NZ | CX1 | CX2 | O1 | 131.8° | 90.0° |
NZ | CX1 | CX2 | H16 | 121.1° | 90.0° |
NZ | CX1 | CX2 | H17 | 121.1° | 90.0° |
CX1 | NZ | CE | CD | 64.9° | 90.0° |
CX1 | NZ | CE | HE2 | 56.3° | 90.0° |
CX1 | NZ | CE | HE3 | 173.9° | 90.0° |
NZ | CX1 | H16 | H17 | 116.4° | 90.0° |
O1 | CX2 | CX1 | H16 | 107.1° | 90.0° |
O1 | CX2 | CX1 | H17 | 10.7° | 90.0° |
CX1 | CX2 | O1 | H1 | 179.5° | 90.0° |
CX2 | CX1 | NZ | HZ1 | 79.2° | 90.0° |
CX2 | CX1 | H16 | H17 | 116.4° | 90.0° |
CE | CD | CG | HD2 | 120.6° | 90.0° |
CE | CD | CG | HD3 | 120.6° | 90.0° |
CE | CD | CG | CB | 151.5° | 90.0° |
CE | CD | CG | HG2 | 88.1° | 90.0° |
CE | CD | CG | HG3 | 31.0° | 90.0° |
CE | CD | HD2 | HD3 | 118.1° | 90.0° |
CD | CE | HE2 | HE3 | 116.2° | 90.0° |
CD | CE | NZ | HZ1 | 57.0° | 90.0° |
CD | CG | CB | HG2 | 120.5° | 90.0° |
CD | CG | CB | HG3 | 120.4° | 90.0° |
CD | CG | CB | CA | 180.0° | 90.0° |
CD | CG | CB | HB2 | 58.9° | 90.0° |
CD | CG | CB | HB3 | 58.9° | 90.0° |
CD | CG | HG2 | HG3 | 118.6° | 90.0° |
CG | CD | HD2 | HD3 | 118.0° | 90.0° |
CG | CD | CE | HE2 | 31.6° | 90.0° |
CG | CD | CE | HE3 | 86.0° | 90.0° |
CG | CB | CA | HB2 | 121.1° | 90.0° |
CG | CB | CA | HB3 | 121.1° | 90.0° |
CG | CB | CA | C | 170.0° | 90.0° |
CG | CB | CA | N | 77.7° | 90.0° |
CG | CB | HB2 | HB3 | 116.6° | 90.0° |
CG | CB | CA | HA | 47.3° | 90.0° |
CB | CG | HG2 | HG3 | 118.7° | 90.0° |
CB | CG | CD | HD2 | 30.9° | 90.0° |
CB | CG | CD | HD3 | 87.9° | 90.0° |
CB | CA | C | N | 118.7° | 90.0° |
CB | CA | C | HA | 122.5° | 90.0° |
CB | CA | N | HA | 124.3° | 90.0° |
CB | CA | C | O | 88.6° | 90.0° |
CB | CA | C | OXT | 95.0° | 90.0° |
CA | CB | HB2 | HB3 | 116.6° | 90.0° |
CB | CA | N | H | 180.0° | 90.0° |
CB | CA | N | H2 | 60.0° | 90.0° |
CA | CB | CG | HG2 | 59.6° | 90.0° |
CA | CB | CG | HG3 | 59.5° | 90.0° |
C | CA | N | HA | 118.3° | 90.0° |
CA | C | O | OXT | 176.1° | 90.0° |
C | CA | CB | HB2 | 48.9° | 90.0° |
C | CA | CB | HB3 | 68.9° | 90.0° |
C | CA | N | H | 62.6° | 90.0° |
C | CA | N | H2 | 57.4° | 90.0° |
CA | C | OXT | HXT | 176.2° | 90.0° |
N | CA | C | O | 30.1° | 90.0° |
N | CA | C | OXT | 146.2° | 90.0° |
N | CA | CB | HB2 | 161.3° | 90.0° |
N | CA | CB | HB3 | 43.4° | 90.0° |
CA | N | H | H2 | 120.0° | 90.0° |
O | C | CA | HA | 148.9° | 90.0° |
O | C | OXT | HXT | 0.0° | 90.0° |
OXT | C | CA | HA | 27.5° | 90.0° |
HB2 | CB | CA | HA | 73.8° | 90.0° |
HB2 | CB | CG | HG2 | 179.3° | 90.0° |
HB2 | CB | CG | HG3 | 61.5° | 90.0° |
HB3 | CB | CA | HA | 168.4° | 90.0° |
HB3 | CB | CG | HG2 | 61.5° | 90.0° |
HB3 | CB | CG | HG3 | 179.4° | 90.0° |
HA | CA | N | H | 55.6° | 90.0° |
HA | CA | N | H2 | 175.6° | 90.0° |
HG2 | CG | CD | HD2 | 151.3° | 90.0° |
HG2 | CG | CD | HD3 | 32.6° | 90.0° |
HG3 | CG | CD | HD2 | 89.6° | 90.0° |
HG3 | CG | CD | HD3 | 151.7° | 90.0° |
HD2 | CD | CE | HE2 | 152.2° | 90.0° |
HD2 | CD | CE | HE3 | 34.7° | 90.0° |
HD3 | CD | CE | HE2 | 89.0° | 90.0° |
HD3 | CD | CE | HE3 | 153.4° | 90.0° |
HE2 | CE | NZ | HZ1 | 178.3° | 90.0° |
HE3 | CE | NZ | HZ1 | 64.2° | 90.0° |
HZ1 | NZ | CX1 | H16 | 159.6° | 90.0° |
HZ1 | NZ | CX1 | H17 | 41.9° | 90.0° |