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Obsolete: SAA

SAA was replaced with APG on
Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2doub1.38Å1.39ÅAromatic
C1C6sing1.38Å1.39ÅAromatic
C1C7sing1.51Å1.54Å
C2C3sing1.38Å1.39ÅAromatic
C2H2sing1.08Å1.10Å
C3C4doub1.38Å1.39ÅAromatic
C3H3sing1.08Å1.10Å
C4C5sing1.38Å1.39ÅAromatic
C4H4sing1.08Å1.10Å
C5C6doub1.38Å1.39ÅAromatic
C5H5sing1.08Å1.10Å
C6H6sing1.08Å1.10Å
C7O8sing1.43Å1.45Å
C7C9sing1.53Å1.54Å
C7C10sing1.51Å1.54Å
O8HO8sing0.97Å0.95Å
C9H91sing1.09Å1.12Å
C9H92sing1.09Å1.12Å
C9H93sing1.09Å1.11Å
C10O1doub1.21Å1.20Å
C10O2sing1.34Å1.20Å
O2HO2sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C6120.1°120.0°
C2C1C7119.9°120.0°
C1C2C3119.8°120.0°
C1C2H2120.1°120.0°
C6C1C7120.0°120.0°
C1C6C5120.0°120.0°
C1C6H6120.0°120.0°
C1C7O8105.6°109.5°
C1C7C9110.0°109.5°
C1C7C10114.2°109.5°
C3C2H2120.1°120.0°
C2C3C4120.1°120.0°
C2C3H3119.9°120.0°
C4C3H3119.9°120.0°
C3C4C5120.0°120.0°
C3C4H4120.1°120.0°
C5C4H4119.9°120.0°
C4C5C6120.0°120.0°
C4C5H5119.9°120.0°
C6C5H5120.0°120.0°
C5C6H6120.0°120.0°
O8C7C9105.5°109.4°
O8C7C10112.1°109.4°
C7O8HO8105.7°106.8°
C9C7C10109.0°109.5°
C7C9H91110.0°109.4°
C7C9H92112.0°109.5°
C7C9H93112.0°109.5°
C7C10O1121.3°120.1°
C7C10O2123.2°120.0°
H91C9H92112.0°109.5°
H91C9H93112.0°109.4°
H92C9H9398.4°109.4°
O1C10O2115.5°119.9°
C10O2HO2123.1°120.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C6C7179.1°179.8°
C1C2C3H2180.0°179.9°
C1C2C3C40.6°0.0°
C1C2C3H3179.4°180.0°
C2C1C6C50.7°0.4°
C2C1C6H6179.3°180.0°
C2C1C7O8170.3°29.9°
C2C1C7C976.3°149.9°
C2C1C7C1046.6°90.0°
C6C1C2C30.9°0.2°
C6C1C2H2179.0°179.7°
C1C6C5C40.1°0.4°
C1C6C5H6180.0°179.5°
C1C6C5H5179.9°179.7°
C6C1C7O88.8°150.3°
C6C1C7C9104.6°30.3°
C6C1C7C10132.4°89.8°
C7C1C2C3180.0°180.0°
C7C1C2H20.0°0.1°
C7C1C6C5179.7°179.8°
C7C1C6H60.3°0.2°
C1C7O8C9116.5°120.0°
C1C7O8C10125.0°120.0°
C1C7C9C10126.0°120.0°
C1C7O8HO8180.0°60.0°
C1C7C9H91180.0°60.0°
C1C7C9H9254.8°180.0°
C1C7C9H9354.7°60.0°
C1C7C10O1170.7°120.0°
C1C7C10O210.1°60.1°
C2C3C4H3180.0°180.0°
C2C3C4C50.0°0.1°
C2C3C4H4180.0°180.0°
H2C2C3C4179.4°180.0°
H2C2C3H30.6°0.0°
C3C4C5H4180.0°179.9°
C3C4C5C60.3°0.1°
C3C4C5H5179.7°180.0°
H3C3C4C5180.0°179.9°
H3C3C4H40.0°0.0°
C4C5C6H5180.0°179.9°
C4C5C6H6179.9°179.9°
H4C4C5C6179.7°179.8°
H4C4C5H50.2°0.1°
H5C5C6H60.1°0.2°
O8C7C9C10120.5°119.9°
O8C7C9H9166.5°180.0°
O8C7C9H9258.7°60.0°
O8C7C9H93168.2°60.1°
O8C7C10O150.6°0.0°
O8C7C10O2130.2°180.0°
C9C7O8HO863.4°180.0°
C7C9H91H92125.2°120.1°
C7C9H91H93125.3°120.0°
C7C9H92H93117.9°120.1°
C9C7C10O165.8°119.9°
C9C7C10O2113.4°60.0°
C10C7O8HO855.0°60.0°
C10C7C9H9154.1°60.1°
C10C7C9H92179.3°60.0°
C10C7C9H9371.2°180.0°
C7C10O1O2179.3°179.9°
C7C10O2HO2180.0°180.0°
H91C9H92H93118.0°119.9°
O1C10O2HO20.8°0.1°

223790

PDB entries from 2024-08-14

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