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A1H39

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C02C01sing1.53Å1.67Å
O01C05sing1.44Å1.45Å
C06C05sing1.55Å1.50Å
C05C04sing1.56Å1.33Å
O04C04sing1.43Å1.43Å
C04C03sing1.55Å1.33Å
O03C03sing1.44Å1.48Å
C03C02sing1.54Å1.45Å
O02C02sing1.43Å1.40Å
C01O01sing1.43Å1.62Å
C06O03sing1.45Å1.56Å
C01H011sing1.09Å1.10Å
C01H012sing1.09Å1.10Å
C02H021sing1.09Å1.10Å
C03H031sing1.09Å1.10Å
C04H041sing1.09Å1.10Å
C05H051sing1.09Å1.10Å
C06H071sing1.09Å1.10Å
C06H072sing1.09Å1.10Å
O02H101sing0.97Å0.95Å
O04H081sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C01C02C03112.4°108.7°
C01C02O02107.4°109.6°
C02C01O01100.7°110.5°
C02C01H011111.6°109.4°
C02C01H012111.6°109.1°
C01C02H021108.9°109.6°
O01C05C06109.0°106.8°
O01C05C04113.3°105.9°
C05O01C01113.3°113.2°
O01C05H051110.8°114.2°
C06C05C04100.4°101.7°
C05C06O03102.1°107.4°
C06C05H051110.1°113.6°
C05C06H071111.3°109.9°
C05C06H072111.3°109.9°
C05C04O04111.6°111.5°
C05C04C03110.8°99.3°
C05C04H041108.3°111.5°
C04C05H051112.7°113.6°
O04C04C03110.5°111.4°
O04C04H041107.1°111.2°
C04O04H081109.5°114.0°
C04C03O03101.2°105.0°
C04C03C02112.7°106.0°
C04C03H031112.6°112.7°
C03C04H041108.4°111.4°
O03C03C02109.1°107.0°
C03O03C06102.3°108.4°
O03C03H031110.2°112.8°
C03C02O02103.6°109.7°
C03C02H021111.8°109.6°
C02C03H031110.6°112.7°
O02C02H021112.7°109.6°
C02O02H101109.5°113.9°
O01C01H011111.6°109.3°
O01C01H012111.6°109.3°
O03C06H071111.3°109.7°
O03C06H072111.3°109.8°
H011C01H012109.5°109.3°
H071C06H072109.5°110.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C02C01O01C0544.7°55.9°
C01C02C03C0458.7°62.9°
C01C02C03O0352.9°48.8°
C01C02C03O02115.6°119.9°
C01C02C03H021122.8°119.8°
C01C02O02H021119.9°120.4°
C02C01O01H011118.5°120.4°
C02C01O01H012118.6°120.1°
C02C01H011H012124.1°119.4°
C01C02C03H031174.2°173.3°
C01C02O02H101180.0°60.0°
O01C05C06C04119.2°110.7°
O01C05C06H051121.8°126.8°
O01C05C04H051126.8°126.1°
O01C05C04O04169.3°169.4°
O01C05C04C0367.1°73.1°
O01C05C06O0393.1°86.9°
C05O01C01H01173.8°64.5°
C05O01C01H012163.3°175.9°
O01C05C04H04151.7°44.5°
O01C05C06H07125.7°32.3°
O01C05C06H072148.1°153.7°
C06C05C04H051117.1°122.5°
C06C05C04O0474.5°79.2°
C06C05C04C0349.0°38.4°
C05C06O03C030.3°2.4°
C06C05O01C0152.1°39.5°
C05C06O03H071118.8°119.4°
C05C06O03H072118.8°119.5°
C06C05C04H041167.8°155.9°
C05C06H071H072123.4°121.2°
C05C04O04C03123.7°109.9°
C05C04O04H041118.4°125.1°
C05C04C03H041118.7°117.6°
C05C04C03O0349.1°41.6°
C05C04C03C0267.3°71.5°
C04C05O01C0158.8°68.2°
C04C05C06O0326.2°23.8°
C05C04C03H031166.7°164.7°
C04C05C06H071145.0°143.1°
C04C05C06H07292.7°95.6°
C05C04O04H081180.0°70.0°
O04C04C03H041117.1°124.9°
O04C04C03O0375.0°76.0°
O04C04C03C02168.6°170.9°
O04C04C03H03142.5°47.1°
O04C04C05H05142.5°43.3°
C04C03O03C02119.0°112.4°
C04C03O03H031119.4°123.1°
C04C03C02H031127.1°123.8°
C04C03C02O0257.0°57.0°
C04C03O03C0625.9°28.1°
C04C03C02H021178.5°177.4°
C03C04C05H051166.1°160.9°
C03C04O04H08156.3°179.9°
O03C03C02H031121.3°124.6°
O03C03C02O02168.5°168.6°
O03C03C02H02169.9°71.0°
O03C03C04H041167.9°159.2°
C03O03C06H071119.1°117.0°
C03O03C06H072118.5°121.9°
C03C02O02H021121.0°120.3°
C03C02C01O0144.7°51.9°
C02C03O03C0693.1°84.3°
C03C02C01H01173.8°68.4°
C03C02C01H012163.3°172.1°
C02C03C04H04151.5°46.1°
C03C02O02H10160.9°179.3°
O02C02C01O0168.5°68.0°
O02C02C01H011172.9°171.7°
O02C02C01H01250.0°52.1°
O02C02C03H03170.1°66.8°
O01C01H011H012124.1°119.5°
O01C01C02H021169.2°171.6°
C01O01C05H051173.5°166.0°
C06O03C03H031145.3°151.2°
O03C06C05H051145.2°146.3°
O03C06H071H072123.4°121.0°
H011C01C02H02150.6°51.3°
H012C01C02H02172.3°68.2°
H021C02C03H03151.4°53.6°
H021C02O02H10160.1°60.3°
H031C03C04H04174.6°77.7°
H041C04C05H05175.1°81.6°
H041C04O04H08161.6°55.1°
H051C05C06H07196.0°94.4°
H051C05C06H07226.3°26.9°

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PDB entries from 2024-10-09

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