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A1LXB

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O1AC1doub1.21Å1.21Å
C1O1Bsing1.34Å1.27Å
C1C2sing1.51Å1.52Å
O2C2sing1.43Å1.41Å
C3C2sing1.55Å1.55Å
C3C4sing1.52Å1.51Å
C2O5sing1.45Å1.41Å
C4O4doub1.21Å1.28Å
C4C5sing1.52Å1.51Å
O5C5sing1.44Å1.43Å
C5C6sing1.53Å1.49Å
C3H1sing1.09Å1.10Å
C3H2sing1.09Å1.10Å
C5H3sing1.09Å1.10Å
C6H4sing1.09Å1.10Å
C6H5sing1.09Å1.10Å
C6H6sing1.09Å1.10Å
O2H7sing0.97Å0.95Å
O1BH8sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1AC1O1B119.3°120.0°
O1AC1C2123.4°120.0°
O1BC1C2117.2°120.0°
C1O1BH8109.5°117.0°
C1C2O2106.1°110.8°
C1C2C3112.9°110.8°
C1C2O5110.3°110.6°
O2C2C3113.4°110.7°
O2C2O5106.1°110.8°
C2O2H7109.5°114.0°
C2C3C4104.6°102.4°
C3C2O5107.8°103.0°
C2C3H1110.6°110.8°
C2C3H2110.7°110.9°
C3C4O4127.2°127.6°
C3C4C5107.0°104.8°
C4C3H1110.7°110.8°
C4C3H2110.7°110.9°
C2O5C5112.0°106.5°
O4C4C5125.7°127.6°
C4C5O5107.6°107.7°
C4C5C6111.5°109.8°
C4C5H3111.1°109.8°
O5C5C6102.6°109.8°
O5C5H3112.3°109.9°
C6C5H3111.4°109.8°
C5C6H4109.5°109.5°
C5C6H5109.5°109.4°
C5C6H6109.5°109.5°
H1C3H2109.5°110.9°
H4C6H5109.5°109.5°
H4C6H6109.4°109.5°
H5C6H6109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1AC1O1BC2179.0°179.9°
O1AC1C2O218.4°111.8°
O1AC1C2C3106.4°124.9°
O1AC1C2O5132.9°11.4°
O1AC1O1BH80.0°0.1°
O1BC1C2O2160.6°68.3°
O1BC1C2C374.6°55.0°
O1BC1C2O546.1°168.5°
C1C2O2C3124.5°123.3°
C1C2O2O5117.4°123.1°
C1C2C3O5122.1°118.3°
C1C2C3C4129.2°155.1°
C1C2O5C5124.9°157.5°
C1C2C3H19.9°86.7°
C1C2C3H2111.6°36.9°
C1C2O2H77.7°56.7°
C2C1O1BH8179.0°180.0°
O2C2C3O5117.1°118.5°
O2C2C3C4110.1°81.6°
O2C2O5C5120.6°79.2°
O2C2C3H1130.7°36.6°
O2C2C3H29.1°160.1°
C2C3C4H1119.2°118.2°
C2C3C4H2119.2°118.3°
C2C3C4O4166.4°159.0°
C2C3C4C59.9°21.3°
C3C2O5C51.2°39.2°
C2C3H1H2122.2°123.5°
C3C2O2H7116.8°180.0°
C4C3C2O57.0°36.9°
C3C4O4C5175.6°179.7°
C3C4C5O59.5°1.5°
C3C4C5C6102.2°121.0°
C4C3H1H2122.2°123.5°
C3C4C5H3132.8°118.1°
C2O5C5C45.2°25.9°
C2O5C5C6112.5°145.4°
O5C2C3H1112.2°155.1°
O5C2C3H2126.3°81.4°
C2O5C5H3127.7°93.7°
O5C2O2H7125.0°66.4°
O4C4C5O5166.8°178.2°
O4C4C5C681.4°58.7°
O4C4C3H174.4°40.8°
O4C4C3H247.1°82.8°
O4C4C5H343.5°62.1°
C4C5O5C6117.7°119.5°
C4C5O5H3122.5°119.6°
C4C5C6H3124.7°120.8°
C5C4C3H1109.3°139.5°
C5C4C3H2129.1°97.0°
C4C5C6H4180.0°60.0°
C4C5C6H560.0°180.0°
C4C5C6H660.0°60.0°
O5C5C6H3120.4°121.0°
O5C5C6H465.1°178.2°
O5C5C6H554.9°61.8°
O5C5C6H6174.9°58.2°
C5C6H4H5120.0°119.9°
C5C6H4H6120.0°120.0°
C5C6H5H6120.0°120.0°
H3C5C6H455.3°60.8°
H3C5C6H5175.3°59.2°
H3C5C6H664.7°179.2°
H4C6H5H6120.0°120.0°

223166

PDB entries from 2024-07-31

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