6ZB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NE1 | CD1 | sing | 1.37Å | 1.38Å | Aromatic |
| NE1 | CE2 | sing | 1.38Å | 1.40Å | Aromatic |
| CD1 | CG | doub | 1.34Å | 1.41Å | Aromatic |
| CE2 | CZ2 | doub | 1.39Å | 1.41Å | Aromatic |
| CE2 | CD2 | sing | 1.41Å | 1.45Å | Aromatic |
| CZ2 | CH2 | sing | 1.38Å | 1.38Å | Aromatic |
| CG | CB | sing | 1.51Å | 1.46Å | |
| CG | CD2 | sing | 1.46Å | 1.42Å | Aromatic |
| CB | CA | sing | 1.53Å | 1.52Å | |
| CD2 | CE3 | doub | 1.40Å | 1.39Å | Aromatic |
| O | C | doub | 1.21Å | 1.22Å | |
| CA | C | sing | 1.51Å | 1.60Å | |
| CA | N | sing | 1.47Å | 1.41Å | |
| CH2 | CZ3 | doub | 1.39Å | 1.41Å | Aromatic |
| C | N03 | sing | 1.35Å | 1.48Å | |
| CE3 | CZ3 | sing | 1.37Å | 1.38Å | Aromatic |
| N03 | O04 | sing | 1.42Å | 1.37Å | |
| N03 | H1 | sing | 0.97Å | 1.00Å | |
| O04 | H2 | sing | 0.97Å | 0.95Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| N | H | sing | 1.01Å | 1.00Å | |
| N | HN2 | sing | 1.01Å | 1.00Å | |
| CB | HB1 | sing | 1.09Å | 1.10Å | |
| CB | HB2 | sing | 1.09Å | 1.10Å | |
| NE1 | HE1 | sing | 0.97Å | 1.00Å | |
| CD1 | HD1 | sing | 1.08Å | 1.08Å | |
| CE3 | HE3 | sing | 1.08Å | 1.08Å | |
| CZ3 | HZ3 | sing | 1.08Å | 1.08Å | |
| CH2 | HH2 | sing | 1.08Å | 1.08Å | |
| CZ2 | HZ2 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CD1 | NE1 | CE2 | 105.2° | 109.9° |
| NE1 | CD1 | CG | 113.0° | 109.9° |
| CD1 | NE1 | HE1 | 127.4° | 125.0° |
| NE1 | CD1 | HD1 | 123.5° | 125.0° |
| NE1 | CE2 | CZ2 | 129.4° | 133.5° |
| NE1 | CE2 | CD2 | 109.6° | 107.1° |
| CE2 | NE1 | HE1 | 127.4° | 125.1° |
| CD1 | CG | CB | 126.8° | 126.5° |
| CD1 | CG | CD2 | 105.6° | 107.0° |
| CG | CD1 | HD1 | 123.5° | 125.0° |
| CZ2 | CE2 | CD2 | 120.9° | 119.4° |
| CE2 | CZ2 | CH2 | 118.7° | 119.8° |
| CE2 | CZ2 | HZ2 | 120.7° | 120.1° |
| CE2 | CD2 | CG | 106.6° | 106.1° |
| CE2 | CD2 | CE3 | 118.3° | 119.9° |
| CZ2 | CH2 | CZ3 | 120.4° | 120.6° |
| CZ2 | CH2 | HH2 | 119.8° | 119.6° |
| CH2 | CZ2 | HZ2 | 120.7° | 120.1° |
| CB | CG | CD2 | 127.6° | 126.5° |
| CG | CB | CA | 114.6° | 109.5° |
| CG | CB | HB1 | 108.2° | 109.5° |
| CG | CB | HB2 | 108.2° | 109.4° |
| CG | CD2 | CE3 | 135.2° | 134.1° |
| CB | CA | C | 108.6° | 109.4° |
| CB | CA | N | 112.7° | 109.5° |
| CB | CA | HA | 109.5° | 109.5° |
| CA | CB | HB1 | 108.2° | 109.5° |
| CA | CB | HB2 | 108.2° | 109.5° |
| CD2 | CE3 | CZ3 | 120.2° | 119.8° |
| CD2 | CE3 | HE3 | 119.9° | 120.1° |
| O | C | CA | 123.3° | 120.0° |
| O | C | N03 | 115.7° | 120.0° |
| C | CA | N | 106.6° | 109.4° |
| CA | C | N03 | 121.0° | 120.0° |
| C | CA | HA | 108.4° | 109.4° |
| N | CA | HA | 111.0° | 109.6° |
| CA | N | H | 109.5° | 111.0° |
| CA | N | HN2 | 109.5° | 111.1° |
| CH2 | CZ3 | CE3 | 121.6° | 120.5° |
| CH2 | CZ3 | HZ3 | 119.2° | 119.7° |
| CZ3 | CH2 | HH2 | 119.8° | 119.7° |
| C | N03 | O04 | 116.7° | 120.0° |
| C | N03 | H1 | 121.7° | 120.0° |
| CZ3 | CE3 | HE3 | 119.9° | 120.2° |
| CE3 | CZ3 | HZ3 | 119.2° | 119.8° |
| O04 | N03 | H1 | 121.7° | 120.0° |
| N03 | O04 | H2 | 109.5° | 114.0° |
| H | N | HN2 | 109.4° | 111.0° |
| HB1 | CB | HB2 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CD1 | NE1 | CE2 | HE1 | 180.0° | 179.7° |
| NE1 | CD1 | CG | HD1 | 180.0° | 179.6° |
| CD1 | NE1 | CE2 | CZ2 | 179.6° | 179.8° |
| CD1 | NE1 | CE2 | CD2 | 0.4° | 0.2° |
| NE1 | CD1 | CG | CB | 179.1° | 179.9° |
| NE1 | CD1 | CG | CD2 | 0.6° | 0.4° |
| CE2 | NE1 | CD1 | CG | 0.1° | 0.4° |
| NE1 | CE2 | CZ2 | CD2 | 179.1° | 180.0° |
| NE1 | CE2 | CZ2 | CH2 | 179.8° | 180.0° |
| NE1 | CE2 | CD2 | CG | 0.7° | 0.0° |
| NE1 | CE2 | CD2 | CE3 | 179.6° | 180.0° |
| CE2 | NE1 | CD1 | HD1 | 179.9° | 180.0° |
| NE1 | CE2 | CZ2 | HZ2 | 0.2° | 0.1° |
| CD1 | CG | CD2 | CE2 | 0.7° | 0.2° |
| CD1 | CG | CB | CD2 | 178.2° | 179.7° |
| CD1 | CG | CB | CA | 84.7° | 95.3° |
| CD1 | CG | CD2 | CE3 | 179.6° | 179.8° |
| CD1 | CG | CB | HB1 | 154.5° | 144.6° |
| CD1 | CG | CB | HB2 | 36.1° | 24.7° |
| CG | CD1 | NE1 | HE1 | 179.9° | 180.0° |
| CE2 | CZ2 | CH2 | HZ2 | 180.0° | 179.9° |
| CZ2 | CE2 | CD2 | CG | 180.0° | 180.0° |
| CZ2 | CE2 | CD2 | CE3 | 0.3° | 0.0° |
| CE2 | CZ2 | CH2 | CZ3 | 0.6° | 0.1° |
| CZ2 | CE2 | NE1 | HE1 | 0.4° | 0.1° |
| CE2 | CZ2 | CH2 | HH2 | 179.4° | 180.0° |
| CD2 | CE2 | CZ2 | CH2 | 0.6° | 0.1° |
| CE2 | CD2 | CG | CB | 179.2° | 180.0° |
| CE2 | CD2 | CG | CE3 | 179.6° | 180.0° |
| CE2 | CD2 | CE3 | CZ3 | 0.1° | 0.0° |
| CD2 | CE2 | NE1 | HE1 | 179.6° | 179.9° |
| CE2 | CD2 | CE3 | HE3 | 179.9° | 180.0° |
| CD2 | CE2 | CZ2 | HZ2 | 179.4° | 180.0° |
| CZ2 | CH2 | CZ3 | HH2 | 180.0° | 179.9° |
| CZ2 | CH2 | CZ3 | CE3 | 0.2° | 0.0° |
| CZ2 | CH2 | CZ3 | HZ3 | 179.7° | 180.0° |
| CG | CB | CA | HB1 | 120.8° | 120.1° |
| CG | CB | CA | HB2 | 120.8° | 120.0° |
| CB | CG | CD2 | CE3 | 1.1° | 0.0° |
| CG | CB | CA | C | 42.0° | 175.0° |
| CG | CB | CA | N | 159.9° | 65.1° |
| CG | CB | CA | HA | 76.1° | 55.0° |
| CG | CB | HB1 | HB2 | 117.7° | 120.0° |
| CB | CG | CD1 | HD1 | 1.0° | 0.3° |
| CD2 | CG | CB | CA | 93.5° | 85.0° |
| CG | CD2 | CE3 | CZ3 | 179.5° | 180.0° |
| CD2 | CG | CB | HB1 | 27.3° | 35.1° |
| CD2 | CG | CB | HB2 | 145.8° | 155.0° |
| CD2 | CG | CD1 | HD1 | 179.5° | 180.0° |
| CG | CD2 | CE3 | HE3 | 0.5° | 0.0° |
| CB | CA | C | O | 85.1° | 100.0° |
| CB | CA | C | N | 121.7° | 119.9° |
| CB | CA | C | HA | 118.8° | 120.0° |
| CB | CA | N | HA | 123.2° | 120.1° |
| CB | CA | C | N03 | 93.3° | 80.3° |
| CB | CA | N | H | 180.0° | 176.0° |
| CB | CA | N | HN2 | 60.0° | 60.0° |
| CA | CB | HB1 | HB2 | 117.7° | 120.0° |
| CD2 | CE3 | CZ3 | CH2 | 0.1° | 0.0° |
| CD2 | CE3 | CZ3 | HE3 | 180.0° | 180.0° |
| CD2 | CE3 | CZ3 | HZ3 | 179.9° | 180.0° |
| O | C | CA | N03 | 178.4° | 179.7° |
| O | C | CA | N | 153.2° | 20.0° |
| O | C | N03 | O04 | 0.7° | 0.0° |
| O | C | N03 | H1 | 179.3° | 180.0° |
| O | C | CA | HA | 33.7° | 140.0° |
| C | CA | N | HA | 117.8° | 120.0° |
| CA | C | N03 | O04 | 179.2° | 179.7° |
| CA | C | N03 | H1 | 0.8° | 0.3° |
| C | CA | N | H | 61.0° | 64.0° |
| C | CA | N | HN2 | 59.0° | 60.0° |
| C | CA | CB | HB1 | 78.7° | 64.9° |
| C | CA | CB | HB2 | 162.8° | 55.0° |
| N | CA | C | N03 | 28.4° | 159.7° |
| CA | N | H | HN2 | 120.0° | 124.0° |
| N | CA | CB | HB1 | 39.1° | 55.0° |
| N | CA | CB | HB2 | 79.4° | 174.9° |
| CH2 | CZ3 | CE3 | HZ3 | 180.0° | 180.0° |
| CH2 | CZ3 | CE3 | HE3 | 179.9° | 180.0° |
| CZ3 | CH2 | CZ2 | HZ2 | 179.4° | 180.0° |
| C | N03 | O04 | H1 | 180.0° | 180.0° |
| C | N03 | O04 | H2 | 0.4° | 180.0° |
| N03 | C | CA | HA | 147.9° | 39.7° |
| CE3 | CZ3 | CH2 | HH2 | 179.7° | 179.9° |
| H1 | N03 | O04 | H2 | 179.6° | 0.0° |
| HA | CA | N | H | 56.8° | 56.0° |
| HA | CA | N | HN2 | 176.8° | 180.0° |
| HA | CA | CB | HB1 | 163.2° | 175.1° |
| HA | CA | CB | HB2 | 44.7° | 64.9° |
| HE1 | NE1 | CD1 | HD1 | 0.1° | 0.3° |
| HE3 | CE3 | CZ3 | HZ3 | 0.1° | 0.0° |
| HZ3 | CZ3 | CH2 | HH2 | 0.3° | 0.0° |
| HH2 | CH2 | CZ2 | HZ2 | 0.6° | 0.1° |
