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A1AXT

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1O1sing1.43Å1.45Å
O1C2sing1.36Å1.33Å
C2N1doub1.32Å1.32ÅAromatic
N1C3sing1.32Å1.35ÅAromatic
C3C4doub1.36Å1.38ÅAromatic
C4C5sing1.40Å1.41ÅAromatic
C5C6sing1.46Å1.43ÅAromatic
C6C7doub1.35Å1.36ÅAromatic
C7N2sing1.37Å1.37ÅAromatic
N2C8sing1.38Å1.38ÅAromatic
C2C8sing1.40Å1.40ÅAromatic
C5C8doub1.41Å1.42ÅAromatic
C1H3sing1.09Å1.10Å
C1H2sing1.09Å1.10Å
C1H1sing1.09Å1.10Å
C3H4sing1.08Å1.08Å
C4H5sing1.08Å1.08Å
C6H6sing1.08Å1.08Å
C7H7sing1.08Å1.08Å
N2H8sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1O1C2117.8°117.0°
O1C1H3109.5°109.5°
O1C1H2109.5°109.5°
O1C1H1109.5°109.5°
O1C2N1122.2°119.9°
O1C2C8116.8°119.9°
C2N1C3119.9°122.5°
N1C2C8120.9°120.1°
N1C3C4123.7°121.4°
N1C3H4118.1°119.3°
C3C4C5117.5°118.9°
C4C3H4118.1°119.4°
C3C4H5121.3°120.5°
C4C5C6134.9°135.2°
C4C5C8118.6°118.7°
C5C4H5121.3°120.6°
C5C6C7107.0°107.0°
C6C5C8106.4°106.1°
C5C6H6126.5°126.5°
C6C7N2110.1°109.9°
C7C6H6126.5°126.5°
C6C7H7124.9°125.0°
C7N2C8108.7°109.9°
N2C7H7124.9°125.1°
C7N2H8125.6°125.1°
N2C8C2133.0°134.4°
N2C8C5107.7°107.1°
C8N2H8125.7°125.0°
C2C8C5119.3°118.5°
H3C1H2109.5°109.4°
H3C1H1109.5°109.5°
H2C1H1109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C1O1C2N17.4°0.1°
C1O1C2C8172.0°179.7°
O1C1H3H2120.0°120.0°
O1C1H3H1120.0°120.0°
O1C1H2H1120.0°120.0°
O1C2N1C8179.4°179.7°
O1C2N1C3179.9°179.7°
O1C2C8N20.5°0.3°
O1C2C8C5179.8°179.7°
C2O1C1H3180.0°59.9°
C2O1C1H260.0°60.0°
C2O1C1H160.0°179.9°
C2N1C3C40.6°0.1°
N1C2C8N2179.9°180.0°
N1C2C8C50.4°0.0°
C2N1C3H4179.5°180.0°
N1C3C4H4180.0°179.9°
N1C3C4C50.4°0.1°
C3N1C2C80.6°0.0°
N1C3C4H5179.6°180.0°
C3C4C5H5180.0°179.9°
C3C4C5C6179.5°179.9°
C3C4C5C80.3°0.0°
C4C5C6C8179.2°180.0°
C4C5C6C7179.8°180.0°
C4C5C8N2180.0°180.0°
C4C5C8C20.3°0.0°
C5C4C3H4179.6°180.0°
C4C5C6H60.2°0.1°
C5C6C7H6180.0°179.9°
C5C6C7N20.4°0.1°
C6C5C8N20.6°0.0°
C6C5C8C2179.7°180.0°
C6C5C4H50.5°0.0°
C5C6C7H7179.6°180.0°
C6C7N2H7180.0°180.0°
C6C7N2C80.0°0.0°
C7C6C5C80.6°0.1°
C6C7N2H8180.0°179.9°
C7N2C8H8180.0°179.9°
C7N2C8C2180.0°180.0°
C7N2C8C50.3°0.0°
N2C7C6H6179.6°180.0°
N2C8C2C5179.7°180.0°
C8N2C7H7180.0°180.0°
C2C8N2H80.0°0.1°
C8C5C4H5179.7°180.0°
C8C5C6H6179.4°179.9°
C5C8N2H8179.6°179.9°
H3C1H2H1120.0°120.0°
H4C3C4H50.4°0.1°
H6C6C7H70.4°0.1°
H7C7N2H80.0°0.1°

248335

PDB entries from 2026-01-28

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