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PRD_900114

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O1C1Asing1.43Å1.39Å
O2C2Asing1.43Å1.44Å
O3C3Asing1.43Å1.44Å
O4C4Asing1.43Å1.46Å
O4CJ1sing1.43Å1.41Å
O5C1Asing1.43Å1.46Å
O5C5Asing1.43Å1.47Å
CJ1CJ2sing1.53Å1.52Å
CJ1OJ5sing1.43Å1.46Å
CJ2OJ2sing1.43Å1.43Å
CJ2CJ3sing1.53Å1.53Å
CJ3OJ3sing1.43Å1.44Å
CJ3CJ4sing1.53Å1.53Å
CJ4CJ5sing1.53Å1.55Å
CJ4OJ4sing1.43Å1.47Å
CJ5CJ6sing1.53Å1.53Å
CJ5OJ5sing1.43Å1.47Å
CJ6OJ6sing1.43Å1.42Å
OJ4CQ1sing1.43Å1.42Å
CQ1CQ2sing1.53Å1.54Å
CQ1OQ5sing1.43Å1.46Å
CQ2CQ3sing1.53Å1.53Å
CQ2OQ2sing1.43Å1.44Å
CQ3OQ3sing1.43Å1.44Å
CQ3CQ4sing1.53Å1.55Å
CQ4OQ4sing1.43Å1.44Å
CQ4CQ5sing1.53Å1.53Å
CQ5OQ5sing1.43Å1.47Å
CQ5CQ6sing1.53Å1.53Å
CQ6OQ6sing1.43Å1.43Å
C1AC2Asing1.53Å1.54Å
C2AC3Asing1.53Å1.53Å
C3AC4Asing1.53Å1.53Å
C4AC5Asing1.53Å1.54Å
C5AC6Asing1.53Å1.53Å
C6AO6sing1.43Å1.43Å
O1H1sing0.97Å0.95Å
O2H2sing0.97Å0.95Å
O3H3sing0.97Å0.95Å
CJ1HJ1sing1.09Å1.10Å
CJ2HJ2sing1.09Å1.10Å
CJ3HJ3sing1.09Å1.10Å
CJ4HJ4sing1.09Å1.10Å
CJ5HJ5sing1.09Å1.10Å
CJ6HJ62sing1.09Å1.10Å
CJ6HJ61sing1.09Å1.10Å
OJ2HAsing0.97Å0.95Å
OJ3HBsing0.97Å0.95Å
OJ6HJ6sing0.97Å0.95Å
CQ1HQ1sing1.09Å1.10Å
CQ2HQ2sing1.09Å1.10Å
CQ3HQ3sing1.09Å1.10Å
CQ4HQ4sing1.09Å1.10Å
CQ5HQ5sing1.09Å1.10Å
CQ6HQ61sing1.09Å1.10Å
CQ6HQ62sing1.09Å1.10Å
OQ2HCsing0.97Å0.95Å
OQ3HDsing0.97Å0.95Å
OQ4HEsing0.97Å0.95Å
OQ6HQ6sing0.97Å0.95Å
C1AH1Asing1.09Å1.10Å
C2AH2Asing1.09Å1.10Å
C3AH3Asing1.09Å1.10Å
C4AH4Asing1.09Å1.10Å
C5AH5Asing1.09Å1.10Å
C6AH6A1sing1.09Å1.10Å
C6AHC6Asing1.09Å1.10Å
O6H6sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1C1AO5109.2°109.5°
O1C1AC2A109.7°109.5°
C1AO1H1109.5°114.0°
O1C1AH1A110.6°109.5°
O2C2AC1A109.5°109.5°
O2C2AC3A109.5°109.5°
C2AO2H2109.5°114.0°
O2C2AH2A110.9°109.5°
O3C3AC2A109.8°109.5°
O3C3AC4A108.9°109.6°
C3AO3H3109.5°114.0°
O3C3AH3A110.4°109.6°
C4AO4CJ1112.7°114.0°
O4C4AC3A109.7°109.5°
O4C4AC5A110.3°109.5°
O4C4AH4A109.8°109.5°
O4CJ1CJ2109.7°109.5°
O4CJ1OJ5107.8°109.5°
O4CJ1HJ1110.4°109.5°
C1AO5C5A113.8°114.2°
O5C1AC2A109.4°109.4°
O5C1AH1A109.5°109.4°
O5C5AC4A109.6°109.4°
O5C5AC6A109.6°109.6°
O5C5AH5A109.0°109.5°
CJ2CJ1OJ5110.5°109.4°
CJ1CJ2OJ2108.6°109.6°
CJ1CJ2CJ3107.5°109.1°
CJ2CJ1HJ1108.8°109.5°
CJ1CJ2HJ2109.8°109.5°
CJ1OJ5CJ5113.1°114.1°
OJ5CJ1HJ1109.6°109.5°
OJ2CJ2CJ3109.9°109.5°
OJ2CJ2HJ2111.2°109.5°
CJ2OJ2HA109.5°114.0°
CJ2CJ3OJ3109.5°109.5°
CJ2CJ3CJ4109.0°109.0°
CJ3CJ2HJ2109.7°109.6°
CJ2CJ3HJ3109.5°109.5°
OJ3CJ3CJ4108.7°109.5°
OJ3CJ3HJ3110.7°109.6°
CJ3OJ3HB109.5°114.0°
CJ3CJ4CJ5109.3°109.1°
CJ3CJ4OJ4109.0°109.5°
CJ4CJ3HJ3109.4°109.6°
CJ3CJ4HJ4109.3°109.5°
CJ5CJ4OJ4110.3°109.6°
CJ4CJ5CJ6113.4°109.5°
CJ4CJ5OJ5109.1°109.4°
CJ5CJ4HJ4109.0°109.5°
CJ4CJ5HJ5107.8°109.5°
CJ4OJ4CQ1112.9°114.1°
OJ4CJ4HJ4110.1°109.5°
CJ6CJ5OJ5109.6°109.5°
CJ5CJ6OJ6109.3°109.5°
CJ6CJ5HJ5108.0°109.5°
CJ5CJ6HJ62109.5°109.5°
CJ5CJ6HJ61109.5°109.5°
OJ5CJ5HJ5108.8°109.5°
OJ6CJ6HJ62109.5°109.5°
OJ6CJ6HJ61109.5°109.5°
CJ6OJ6HJ6109.5°114.0°
OJ4CQ1CQ2110.3°109.5°
OJ4CQ1OQ5107.3°109.4°
OJ4CQ1HQ1110.5°109.4°
CQ2CQ1OQ5110.1°109.4°
CQ1CQ2CQ3107.1°109.2°
CQ1CQ2OQ2109.7°109.5°
CQ2CQ1HQ1108.9°109.6°
CQ1CQ2HQ2109.8°109.5°
CQ1OQ5CQ5113.3°114.1°
OQ5CQ1HQ1109.9°109.5°
CQ3CQ2OQ2109.2°109.5°
CQ2CQ3OQ3109.2°109.5°
CQ2CQ3CQ4108.2°109.0°
CQ3CQ2HQ2109.9°109.6°
CQ2CQ3HQ3109.7°109.6°
OQ2CQ2HQ2111.2°109.6°
CQ2OQ2HC109.5°114.0°
OQ3CQ3CQ4109.2°109.5°
OQ3CQ3HQ3111.0°109.5°
CQ3OQ3HD109.5°114.0°
CQ3CQ4OQ4109.6°109.5°
CQ3CQ4CQ5109.6°109.1°
CQ4CQ3HQ3109.5°109.6°
CQ3CQ4HQ4109.5°109.6°
OQ4CQ4CQ5107.4°109.5°
OQ4CQ4HQ4111.0°109.5°
CQ4OQ4HE109.5°114.0°
CQ4CQ5OQ5109.2°109.4°
CQ4CQ5CQ6112.1°109.5°
CQ5CQ4HQ4109.7°109.5°
CQ4CQ5HQ5108.4°109.5°
OQ5CQ5CQ6109.3°109.5°
OQ5CQ5HQ5109.3°109.5°
CQ5CQ6OQ6109.4°109.4°
CQ6CQ5HQ5108.5°109.5°
CQ5CQ6HQ61109.5°109.5°
CQ5CQ6HQ62109.5°109.5°
OQ6CQ6HQ61109.5°109.5°
OQ6CQ6HQ62109.5°109.5°
CQ6OQ6HQ6109.5°114.0°
C1AC2AC3A107.9°109.2°
C2AC1AH1A108.5°109.5°
C1AC2AH2A109.4°109.5°
C2AC3AC4A109.4°109.1°
C3AC2AH2A109.5°109.6°
C2AC3AH3A109.1°109.5°
C3AC4AC5A109.6°109.2°
C4AC3AH3A109.2°109.6°
C3AC4AH4A108.9°109.5°
C4AC5AC6A112.4°109.5°
C5AC4AH4A108.6°109.6°
C4AC5AH5A108.1°109.4°
C5AC6AO6108.9°109.5°
C6AC5AH5A108.2°109.5°
C5AC6AH6A1109.6°109.5°
C5AC6AHC6A109.6°109.4°
O6C6AH6A1109.6°109.5°
O6C6AHC6A109.6°109.4°
C6AO6H6109.5°114.0°
HJ62CJ6HJ61109.5°109.4°
HQ61CQ6HQ62109.5°109.5°
H6A1C6AHC6A109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1C1AC2AO261.1°62.5°
O1C1AO5C2A120.1°120.0°
O1C1AO5H1A121.2°120.0°
O1C1AO5C5A179.8°178.9°
O1C1AC2AH1A120.9°120.1°
O1C1AC2AC3A179.7°177.6°
O1C1AC2AH2A60.6°57.6°
O2C2AC3AO360.8°63.2°
O2C2AC1AO5179.1°177.5°
O2C2AC1AC3A119.2°119.9°
O2C2AC1AH2A121.7°120.1°
O2C2AC3AH2A121.8°120.2°
O2C2AC3AC4A179.8°176.9°
O2C2AC1AH1A59.8°57.5°
O2C2AC3AH3A60.4°56.9°
O3C3AC4AO457.7°57.0°
O3C3AC2AC1A180.0°176.9°
O3C3AC2AC4A119.4°119.9°
O3C3AC2AH3A121.2°120.2°
O3C3AC4AH3A120.6°120.3°
O3C3AC4AC5A179.0°176.8°
O3C3AC2AH2A61.0°56.9°
O3C3AC4AH4A62.4°63.2°
O4C4AC5AO565.1°62.3°
C4AO4CJ1CJ2144.7°175.0°
C4AO4CJ1OJ594.9°65.1°
O4C4AC3AC2A62.3°62.9°
O4C4AC3AC5A121.2°119.8°
O4C4AC3AH4A120.1°120.1°
O4C4AC5AH4A120.3°120.1°
O4C4AC5AC6A57.0°57.7°
C4AO4CJ1HJ124.8°55.0°
O4C4AC3AH3A178.4°177.2°
O4C4AC5AH5A176.3°177.7°
O4CJ1CJ2OJ5118.7°120.0°
O4CJ1CJ2HJ1120.8°120.0°
O4CJ1OJ5HJ1120.2°120.0°
O4CJ1CJ2OJ261.9°62.5°
O4CJ1CJ2CJ3179.2°177.6°
O4CJ1OJ5CJ5180.0°178.8°
CJ1O4C4AC3A106.4°90.0°
CJ1O4C4AC5A132.8°150.3°
O4CJ1CJ2HJ259.9°57.7°
CJ1O4C4AH4A13.1°30.1°
O5C1AC2AH1A119.3°119.9°
O5C1AC2AC3A59.9°57.5°
C1AO5C5AC4A57.6°61.1°
C1AO5C5AC6A178.7°178.9°
O5C1AO1H1180.0°60.0°
O5C1AC2AH2A59.2°62.4°
C1AO5C5AH5A60.5°58.8°
C5AO5C1AC2A60.1°61.1°
O5C5AC4AC3A55.8°57.5°
O5C5AC4AC6A122.1°120.1°
O5C5AC4AH5A118.6°119.9°
O5C5AC6AH5A118.7°120.0°
O5C5AC6AO637.7°64.9°
C5AO5C1AH1A58.6°58.8°
O5C5AC4AH4A174.6°177.5°
O5C5AC6AH6A1157.6°175.0°
O5C5AC6AHC6A82.2°55.0°
CJ2CJ1OJ5HJ1120.0°120.0°
CJ1CJ2OJ2CJ3117.4°119.7°
CJ1CJ2OJ2HJ2120.9°120.1°
CJ1CJ2CJ3HJ2119.4°119.9°
CJ1CJ2CJ3OJ3180.0°176.8°
CJ1CJ2CJ3CJ461.3°57.0°
CJ2CJ1OJ5CJ560.1°61.2°
CJ1CJ2CJ3HJ358.4°63.0°
CJ1CJ2OJ2HA180.0°59.9°
OJ5CJ1CJ2OJ2179.4°177.5°
OJ5CJ1CJ2CJ360.5°57.6°
CJ1OJ5CJ5CJ457.1°61.2°
CJ1OJ5CJ5CJ6178.2°178.9°
OJ5CJ1CJ2HJ258.9°62.3°
CJ1OJ5CJ5HJ560.2°58.8°
OJ2CJ2CJ3HJ2122.6°120.2°
OJ2CJ2CJ3OJ362.0°63.2°
OJ2CJ2CJ3CJ4179.3°176.9°
OJ2CJ2CJ1HJ158.9°57.5°
OJ2CJ2CJ3HJ359.6°56.9°
CJ2CJ3OJ3CJ4118.9°119.6°
CJ2CJ3OJ3HJ3120.8°120.2°
CJ2CJ3CJ4HJ3119.7°119.9°
CJ2CJ3CJ4CJ560.1°57.0°
CJ2CJ3CJ4OJ460.4°62.9°
CJ3CJ2CJ1HJ159.9°62.4°
CJ2CJ3CJ4HJ4179.2°176.9°
CJ3CJ2OJ2HA62.6°179.6°
CJ2CJ3OJ3HB180.0°60.0°
OJ3CJ3CJ4HJ3121.0°120.2°
OJ3CJ3CJ4CJ5179.4°176.9°
OJ3CJ3CJ4OJ458.8°56.9°
OJ3CJ3CJ2HJ260.6°57.0°
OJ3CJ3CJ4HJ461.5°63.2°
CJ3CJ4CJ5OJ4119.8°119.9°
CJ3CJ4CJ5HJ4119.3°119.9°
CJ3CJ4OJ4HJ4119.8°120.2°
CJ3CJ4CJ5CJ6179.0°177.6°
CJ3CJ4CJ5OJ556.5°57.7°
CJ3CJ4OJ4CQ1120.8°90.0°
CJ4CJ3CJ2HJ258.1°62.9°
CJ3CJ4CJ5HJ561.5°62.4°
CJ4CJ3OJ3HB61.1°179.5°
CJ5CJ4OJ4HJ4120.3°120.2°
CJ4CJ5CJ6OJ5122.2°119.9°
CJ4CJ5CJ6HJ5119.4°120.0°
CJ4CJ5OJ5HJ5117.3°120.0°
CJ4CJ5CJ6OJ677.3°175.0°
CJ5CJ4OJ4CQ1119.3°150.3°
CJ5CJ4CJ3HJ359.6°62.9°
CJ4CJ5CJ6HJ62162.8°55.0°
CJ4CJ5CJ6HJ6142.7°65.0°
OJ4CJ4CJ5CJ659.2°57.7°
OJ4CJ4CJ5OJ563.2°62.3°
CJ4OJ4CQ1CQ2144.3°175.0°
CJ4OJ4CQ1OQ595.9°65.0°
OJ4CJ4CJ3HJ3179.8°177.2°
OJ4CJ4CJ5HJ5178.8°177.7°
CJ4OJ4CQ1HQ123.9°54.9°
CJ6CJ5OJ5HJ5117.9°120.0°
CJ5CJ6OJ6HJ62120.0°120.0°
CJ5CJ6OJ6HJ61120.0°120.0°
CJ6CJ5CJ4HJ461.7°62.5°
CJ5CJ6HJ62HJ61120.1°120.0°
CJ5CJ6OJ6HJ6180.0°180.0°
OJ5CJ5CJ6OJ644.9°65.1°
CJ5OJ5CJ1HJ159.8°58.8°
OJ5CJ5CJ4HJ4175.8°177.6°
OJ5CJ5CJ6HJ6275.1°174.9°
OJ5CJ5CJ6HJ61164.9°54.9°
OJ6CJ6CJ5HJ5163.3°55.0°
OJ6CJ6HJ62HJ61120.1°120.0°
OJ4CQ1CQ2OQ5118.2°120.0°
OJ4CQ1CQ2HQ1121.3°120.0°
OJ4CQ1OQ5HQ1120.1°119.9°
OJ4CQ1CQ2CQ3179.1°177.6°
OJ4CQ1CQ2OQ262.6°62.5°
OJ4CQ1OQ5CQ5179.5°178.8°
CQ1OJ4CJ4HJ41.0°30.2°
OJ4CQ1CQ2HQ259.9°57.7°
CQ2CQ1OQ5HQ1119.9°120.1°
CQ1CQ2CQ3OQ2118.6°119.8°
CQ1CQ2CQ3HQ2119.2°119.9°
CQ1CQ2OQ2HQ2121.6°120.2°
CQ1CQ2CQ3OQ3180.0°176.9°
CQ1CQ2CQ3CQ461.3°57.0°
CQ2CQ1OQ5CQ560.5°61.2°
CQ1CQ2CQ3HQ358.2°62.9°
CQ1CQ2OQ2HC180.0°60.0°
OQ5CQ1CQ2CQ361.0°57.7°
OQ5CQ1CQ2OQ2179.3°177.5°
CQ1OQ5CQ5CQ457.7°61.1°
CQ1OQ5CQ5CQ6179.3°178.9°
OQ5CQ1CQ2HQ258.3°62.3°
CQ1OQ5CQ5HQ560.7°58.9°
CQ3CQ2OQ2HQ2121.4°120.2°
CQ2CQ3OQ3CQ4118.1°119.5°
CQ2CQ3OQ3HQ3121.1°120.2°
CQ2CQ3CQ4HQ3119.6°120.0°
CQ2CQ3CQ4OQ457.0°62.9°
CQ2CQ3CQ4CQ560.6°57.0°
CQ3CQ2CQ1HQ159.5°62.4°
CQ2CQ3CQ4HQ4179.1°177.0°
CQ3CQ2OQ2HC63.0°179.7°
CQ2CQ3OQ3HD180.0°60.0°
OQ2CQ2CQ3OQ361.3°63.3°
OQ2CQ2CQ3CQ4179.9°176.9°
OQ2CQ2CQ1HQ158.8°57.5°
OQ2CQ2CQ3HQ360.5°56.9°
OQ3CQ3CQ4HQ3121.7°120.2°
OQ3CQ3CQ4OQ461.7°56.9°
OQ3CQ3CQ4CQ5179.3°176.8°
OQ3CQ3CQ2HQ260.9°56.9°
OQ3CQ3CQ4HQ460.4°63.2°
CQ3CQ4OQ4CQ5119.0°119.7°
CQ3CQ4OQ4HQ4121.1°120.2°
CQ3CQ4CQ5HQ4120.2°120.0°
CQ3CQ4CQ5OQ557.0°57.6°
CQ3CQ4CQ5CQ6178.2°177.6°
CQ4CQ3CQ2HQ257.9°62.9°
CQ3CQ4CQ5HQ562.1°62.4°
CQ4CQ3OQ3HD61.8°179.5°
CQ3CQ4OQ4HE180.0°60.0°
OQ4CQ4CQ5HQ4120.8°120.1°
OQ4CQ4CQ5OQ562.0°62.3°
OQ4CQ4CQ5CQ659.2°57.7°
OQ4CQ4CQ3HQ3176.6°177.2°
OQ4CQ4CQ5HQ5178.9°177.7°
CQ4CQ5OQ5CQ6122.9°119.9°
CQ4CQ5OQ5HQ5118.5°120.0°
CQ4CQ5CQ6HQ5119.7°120.0°
CQ4CQ5CQ6OQ6148.5°175.0°
CQ5CQ4CQ3HQ359.0°62.9°
CQ4CQ5CQ6HQ6191.6°55.0°
CQ4CQ5CQ6HQ6228.5°65.0°
CQ5CQ4OQ4HE61.0°179.7°
OQ5CQ5CQ6HQ5119.1°120.1°
OQ5CQ5CQ6OQ627.3°65.1°
CQ5OQ5CQ1HQ159.4°58.9°
OQ5CQ5CQ4HQ4177.2°177.6°
OQ5CQ5CQ6HQ61147.2°175.0°
OQ5CQ5CQ6HQ6292.7°54.9°
CQ5CQ6OQ6HQ61120.0°120.0°
CQ5CQ6OQ6HQ62120.0°120.0°
CQ6CQ5CQ4HQ461.6°62.5°
CQ5CQ6HQ61HQ62120.1°120.0°
CQ5CQ6OQ6HQ6180.0°180.0°
OQ6CQ6CQ5HQ591.9°55.0°
OQ6CQ6HQ61HQ62120.0°120.0°
C1AC2AC3AH2A119.0°119.9°
C1AC2AC3AC4A60.6°56.9°
C2AC1AO1H160.1°180.0°
C1AC2AO2H2180.0°60.0°
C1AC2AC3AH3A58.8°63.0°
C2AC3AC4AH3A119.4°119.8°
C2AC3AC4AC5A59.0°56.9°
C3AC2AO2H261.8°179.7°
C2AC3AO3H3180.0°59.9°
C3AC2AC1AH1A59.4°62.4°
C2AC3AC4AH4A177.6°176.9°
C3AC4AC5AH4A118.8°120.0°
C3AC4AC5AC6A177.9°177.6°
C4AC3AO3H360.2°179.5°
C4AC3AC2AH2A58.4°63.0°
C3AC4AC5AH5A62.8°62.4°
C4AC5AC6AH5A119.2°119.9°
C4AC5AC6AO6159.8°175.0°
C5AC4AC3AH3A60.4°62.9°
C4AC5AC6AH6A180.3°55.0°
C4AC5AC6AHC6A39.8°65.0°
C5AC6AO6H6A1119.9°120.0°
C5AC6AO6HC6A119.9°119.9°
C6AC5AC4AH4A63.3°62.4°
C5AC6AH6A1HC6A120.2°120.0°
C5AC6AO6H6180.0°180.0°
O6C6AC5AH5A81.0°55.1°
O6C6AH6A1HC6A120.3°120.0°
H1O1C1AH1A59.5°60.0°
H2O2C2AH2A59.1°60.1°
H3O3C3AH3A59.6°60.2°
HJ1CJ1CJ2HJ2179.3°177.6°
HJ2CJ2CJ3HJ3177.8°177.1°
HJ2CJ2OJ2HA59.1°60.2°
HJ3CJ3CJ4HJ459.5°57.0°
HJ3CJ3OJ3HB59.2°60.2°
HJ4CJ4CJ5HJ557.8°57.5°
HJ5CJ5CJ6HJ6243.4°65.0°
HJ5CJ5CJ6HJ6176.7°175.0°
HJ62CJ6OJ6HJ660.0°60.0°
HJ61CJ6OJ6HJ660.0°60.0°
HQ1CQ1CQ2HQ2178.8°177.7°
HQ2CQ2CQ3HQ3177.3°177.1°
HQ2CQ2OQ2HC58.4°60.1°
HQ3CQ3CQ4HQ461.3°57.0°
HQ3CQ3OQ3HD59.0°60.2°
HQ4CQ4CQ5HQ558.1°57.6°
HQ4CQ4OQ4HE58.9°60.2°
HQ5CQ5CQ6HQ6128.1°65.0°
HQ5CQ5CQ6HQ62148.2°175.0°
HQ61CQ6OQ6HQ660.0°60.0°
HQ62CQ6OQ6HQ660.0°60.1°
H1AC1AC2AH2A178.5°177.7°
H2AC2AC3AH3A177.8°177.1°
H3AC3AC4AH4A58.3°57.1°
H4AC4AC5AH5A56.0°57.6°
H5AC5AC6AH6A138.9°64.9°
H5AC5AC6AHC6A159.1°175.0°
H6A1C6AO6H660.1°60.0°
HC6AC6AO6H660.1°60.1°

219869

PDB entries from 2024-05-15

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