7QK
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CT | CH2 | sing | 1.51Å | 1.53Å | |
CH2 | OT | doub | 1.21Å | 1.20Å | |
CH2 | NZ | sing | 1.35Å | 1.43Å | |
NZ | CH1 | sing | 1.46Å | 1.47Å | |
NZ | CE | sing | 1.47Å | 1.44Å | |
CE | CD | sing | 1.53Å | 1.51Å | |
CD | CG | sing | 1.53Å | 1.53Å | |
CG | CB | sing | 1.53Å | 1.55Å | |
CB | CA | sing | 1.53Å | 1.56Å | |
N | CA | sing | 1.47Å | 1.43Å | |
CA | C | sing | 1.51Å | 1.49Å | |
C | O | doub | 1.21Å | 1.20Å | |
N | H2 | sing | 1.01Å | 1.00Å | |
N | H | sing | 1.01Å | 1.00Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CB | HB3 | sing | 1.09Å | 1.10Å | |
CB | HB2 | sing | 1.09Å | 1.10Å | |
CG | HG3 | sing | 1.09Å | 1.10Å | |
CG | HG2 | sing | 1.09Å | 1.10Å | |
CD | HD2 | sing | 1.09Å | 1.10Å | |
CD | HD3 | sing | 1.09Å | 1.10Å | |
CE | HE2 | sing | 1.09Å | 1.10Å | |
CE | HE3 | sing | 1.09Å | 1.10Å | |
CH1 | HH12 | sing | 1.09Å | 1.10Å | |
CH1 | HH11 | sing | 1.09Å | 1.10Å | |
CH1 | HH13 | sing | 1.09Å | 1.10Å | |
CT | HT3 | sing | 1.09Å | 1.10Å | |
CT | HT1 | sing | 1.09Å | 1.10Å | |
CT | HT2 | sing | 1.09Å | 1.10Å | |
C | OXT | sing | 1.34Å | 1.31Å | |
OXT | HXT | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CT | CH2 | OT | 124.5° | 120.1° |
CT | CH2 | NZ | 117.9° | 120.0° |
CH2 | CT | HT3 | 109.5° | 109.5° |
CH2 | CT | HT1 | 109.4° | 109.5° |
CH2 | CT | HT2 | 109.5° | 109.5° |
OT | CH2 | NZ | 117.6° | 120.0° |
CH2 | NZ | CH1 | 120.6° | 120.0° |
CH2 | NZ | CE | 118.2° | 120.0° |
CH1 | NZ | CE | 121.1° | 120.0° |
NZ | CH1 | HH12 | 109.5° | 109.5° |
NZ | CH1 | HH11 | 109.5° | 109.5° |
NZ | CH1 | HH13 | 109.5° | 109.5° |
NZ | CE | CD | 105.7° | 109.4° |
NZ | CE | HE2 | 110.4° | 109.5° |
NZ | CE | HE3 | 110.4° | 109.5° |
CE | CD | CG | 110.4° | 109.5° |
CE | CD | HD2 | 109.3° | 109.4° |
CE | CD | HD3 | 109.2° | 109.5° |
CD | CE | HE2 | 110.4° | 109.5° |
CD | CE | HE3 | 110.4° | 109.5° |
CD | CG | CB | 110.2° | 109.5° |
CD | CG | HG3 | 109.3° | 109.5° |
CD | CG | HG2 | 109.3° | 109.5° |
CG | CD | HD2 | 109.3° | 109.5° |
CG | CD | HD3 | 109.2° | 109.5° |
CG | CB | CA | 112.2° | 109.5° |
CG | CB | HB3 | 108.8° | 109.5° |
CG | CB | HB2 | 108.8° | 109.4° |
CB | CG | HG3 | 109.3° | 109.5° |
CB | CG | HG2 | 109.3° | 109.5° |
CB | CA | N | 102.9° | 109.4° |
CB | CA | C | 107.7° | 109.4° |
CB | CA | HA | 103.6° | 109.4° |
CA | CB | HB3 | 108.8° | 109.5° |
CA | CB | HB2 | 108.8° | 109.5° |
N | CA | C | 130.6° | 109.5° |
CA | N | H2 | 109.5° | 111.0° |
CA | N | H | 109.4° | 111.0° |
N | CA | HA | 105.0° | 109.5° |
CA | C | O | 117.7° | 120.0° |
C | CA | HA | 104.3° | 109.5° |
CA | C | OXT | 118.2° | 120.0° |
O | C | OXT | 124.1° | 120.0° |
H2 | N | H | 109.5° | 110.9° |
HB3 | CB | HB2 | 109.5° | 109.5° |
HG3 | CG | HG2 | 109.4° | 109.5° |
HD2 | CD | HD3 | 109.5° | 109.5° |
HE2 | CE | HE3 | 109.5° | 109.5° |
HH12 | CH1 | HH11 | 109.5° | 109.5° |
HH12 | CH1 | HH13 | 109.4° | 109.5° |
HH11 | CH1 | HH13 | 109.5° | 109.5° |
HT3 | CT | HT1 | 109.4° | 109.5° |
HT3 | CT | HT2 | 109.5° | 109.5° |
HT1 | CT | HT2 | 109.5° | 109.4° |
C | OXT | HXT | 109.5° | 117.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CT | CH2 | OT | NZ | 178.0° | 180.0° |
CT | CH2 | NZ | CH1 | 1.2° | 0.1° |
CT | CH2 | NZ | CE | 179.0° | 180.0° |
CH2 | CT | HT3 | HT1 | 120.0° | 120.1° |
CH2 | CT | HT3 | HT2 | 120.0° | 120.0° |
CH2 | CT | HT1 | HT2 | 120.0° | 120.0° |
OT | CH2 | NZ | CH1 | 177.0° | 180.0° |
OT | CH2 | NZ | CE | 0.8° | 0.1° |
OT | CH2 | CT | HT3 | 0.0° | 90.0° |
OT | CH2 | CT | HT1 | 120.0° | 150.0° |
OT | CH2 | CT | HT2 | 120.0° | 30.0° |
CH2 | NZ | CH1 | CE | 177.8° | 179.9° |
CH2 | NZ | CE | CD | 95.6° | 90.1° |
CH2 | NZ | CE | HE2 | 23.8° | 150.0° |
CH2 | NZ | CE | HE3 | 145.1° | 29.9° |
CH2 | NZ | CH1 | HH12 | 180.0° | 89.9° |
CH2 | NZ | CH1 | HH11 | 60.0° | 30.0° |
CH2 | NZ | CH1 | HH13 | 60.0° | 150.0° |
NZ | CH2 | CT | HT3 | 178.0° | 90.0° |
NZ | CH2 | CT | HT1 | 62.0° | 30.1° |
NZ | CH2 | CT | HT2 | 58.0° | 150.0° |
CH1 | NZ | CE | CD | 86.6° | 90.0° |
CH1 | NZ | CE | HE2 | 154.0° | 30.0° |
CH1 | NZ | CE | HE3 | 32.8° | 150.0° |
NZ | CH1 | HH12 | HH11 | 120.0° | 120.0° |
NZ | CH1 | HH12 | HH13 | 120.0° | 120.0° |
NZ | CH1 | HH11 | HH13 | 120.0° | 120.0° |
NZ | CE | CD | HE2 | 119.4° | 120.0° |
NZ | CE | CD | HE3 | 119.4° | 120.0° |
NZ | CE | CD | CG | 163.4° | 180.0° |
NZ | CE | CD | HD2 | 43.3° | 60.0° |
NZ | CE | CD | HD3 | 76.5° | 60.0° |
NZ | CE | HE2 | HE3 | 121.7° | 120.1° |
CE | NZ | CH1 | HH12 | 2.2° | 90.0° |
CE | NZ | CH1 | HH11 | 117.8° | 150.0° |
CE | NZ | CH1 | HH13 | 122.2° | 30.0° |
CE | CD | CG | HD2 | 120.1° | 119.9° |
CE | CD | CG | HD3 | 120.1° | 120.0° |
CE | CD | CG | CB | 174.7° | 180.0° |
CE | CD | CG | HG3 | 65.1° | 60.1° |
CE | CD | CG | HG2 | 54.6° | 60.0° |
CE | CD | HD2 | HD3 | 119.6° | 120.0° |
CD | CE | HE2 | HE3 | 121.7° | 120.0° |
CD | CG | CB | HG3 | 120.1° | 120.0° |
CD | CG | CB | HG2 | 120.1° | 120.0° |
CD | CG | CB | CA | 160.8° | 179.9° |
CD | CG | CB | HB3 | 78.8° | 60.0° |
CD | CG | CB | HB2 | 40.4° | 60.0° |
CD | CG | HG3 | HG2 | 119.6° | 120.1° |
CG | CD | HD2 | HD3 | 119.6° | 120.1° |
CG | CD | CE | HE2 | 77.2° | 60.1° |
CG | CD | CE | HE3 | 44.0° | 60.0° |
CG | CB | CA | HB3 | 120.4° | 120.0° |
CG | CB | CA | HB2 | 120.4° | 119.9° |
CG | CB | CA | N | 53.6° | 65.0° |
CG | CB | CA | C | 165.7° | 175.0° |
CG | CB | CA | HA | 55.5° | 55.0° |
CG | CB | HB3 | HB2 | 118.8° | 120.0° |
CB | CG | HG3 | HG2 | 119.7° | 120.0° |
CB | CG | CD | HD2 | 54.6° | 60.0° |
CB | CG | CD | HD3 | 65.2° | 60.0° |
CB | CA | N | C | 127.4° | 120.0° |
CB | CA | N | HA | 108.1° | 119.9° |
CB | CA | C | HA | 109.6° | 120.0° |
CB | CA | C | O | 59.8° | 100.0° |
CB | CA | N | H2 | 180.0° | 176.1° |
CB | CA | N | H | 60.0° | 60.1° |
CA | CB | HB3 | HB2 | 118.8° | 120.0° |
CA | CB | CG | HG3 | 40.6° | 60.0° |
CA | CB | CG | HG2 | 79.1° | 60.0° |
CB | CA | C | OXT | 123.1° | 80.0° |
N | CA | C | HA | 124.8° | 120.1° |
N | CA | C | O | 174.6° | 19.9° |
CA | N | H2 | H | 120.0° | 123.9° |
N | CA | CB | HB3 | 174.0° | 55.0° |
N | CA | CB | HB2 | 66.8° | 175.1° |
N | CA | C | OXT | 2.5° | 160.0° |
CA | C | O | OXT | 177.0° | 180.0° |
C | CA | N | H2 | 52.6° | 63.9° |
C | CA | N | H | 67.4° | 59.9° |
C | CA | CB | HB3 | 45.3° | 65.0° |
C | CA | CB | HB2 | 74.0° | 55.1° |
CA | C | OXT | HXT | 176.9° | 180.0° |
O | C | CA | HA | 49.9° | 140.0° |
O | C | OXT | HXT | 0.0° | 0.0° |
H2 | N | CA | HA | 71.9° | 56.2° |
H | N | CA | HA | 168.1° | 180.0° |
HA | CA | CB | HB3 | 64.9° | 175.0° |
HA | CA | CB | HB2 | 175.9° | 65.0° |
HA | CA | C | OXT | 127.3° | 40.0° |
HB3 | CB | CG | HG3 | 161.0° | 180.0° |
HB3 | CB | CG | HG2 | 41.3° | 60.0° |
HB2 | CB | CG | HG3 | 79.8° | 60.0° |
HB2 | CB | CG | HG2 | 160.5° | 179.9° |
HG3 | CG | CD | HD2 | 174.7° | 180.0° |
HG3 | CG | CD | HD3 | 55.0° | 60.0° |
HG2 | CG | CD | HD2 | 65.5° | 60.0° |
HG2 | CG | CD | HD3 | 174.7° | 180.0° |
HD2 | CD | CE | HE2 | 162.7° | 180.0° |
HD2 | CD | CE | HE3 | 76.1° | 60.0° |
HD3 | CD | CE | HE2 | 42.9° | 60.0° |
HD3 | CD | CE | HE3 | 164.1° | 180.0° |
HH12 | CH1 | HH11 | HH13 | 120.0° | 120.0° |
HT3 | CT | HT1 | HT2 | 120.0° | 120.0° |