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A2D

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
PAO5Dsing1.62Å1.61Å
PAO3Asing1.62Å1.31Å
PAO2Adoub1.50Å1.39Å
PAO1Asing1.62Å1.62Å
O1AHO1Asing0.98Å0.95Å
O3APBsing1.62Å1.46Å
PBO5Esing1.62Å1.59Å
PBO1Bdoub1.50Å1.49Å
PBO2Bsing1.62Å1.50Å
O2BHO2Bsing0.98Å0.95Å
O5DC5Dsing1.42Å1.42Å
C5DC4Dsing1.52Å1.52Å
C5DHD1sing1.09Å1.10Å
C5DHD2sing1.09Å1.10Å
C4DO4Dsing1.45Å1.42Å
C4DC3Dsing1.53Å1.52Å
C4DH4Dsing1.09Å1.10Å
O4DC1Dsing1.44Å1.42Å
C3DC2Dsing1.52Å1.53Å
C3DO3Dsing1.43Å1.43Å
C3DH3CAsing1.09Å1.10Å
O3DH3OAsing0.97Å0.95Å
C2DC1Dsing1.52Å1.52Å
C2DO2Dsing1.41Å1.44Å
C2DH2CAsing1.10Å1.10Å
O2DH2OAsing0.97Å0.95Å
C1DN9Asing1.46Å1.48Å
C1DH1Dsing1.10Å1.10Å
N9AC8Asing1.37Å1.35ÅAromatic
N9AC4Asing1.37Å1.34ÅAromatic
C8AN7Adoub1.32Å1.35ÅAromatic
C8AH8Asing1.08Å1.08Å
N7AC5Asing1.37Å1.36ÅAromatic
C5AC6Asing1.39Å1.41ÅAromatic
C5AC4Adoub1.39Å1.39ÅAromatic
C6AN6Asing1.41Å1.36Å
C6AN1Adoub1.35Å1.35ÅAromatic
N6AH6A1sing1.00Å1.00Å
N6AH6A2sing1.00Å1.00Å
N1AC2Asing1.35Å1.34ÅAromatic
C2AN3Adoub1.35Å1.34ÅAromatic
C2AH2Asing1.09Å1.08Å
N3AC4Asing1.34Å1.37ÅAromatic
O5EC5Esing1.42Å1.42Å
C5EC4Esing1.52Å1.51Å
C5EHE1sing1.09Å1.10Å
C5EHE2sing1.09Å1.10Å
C4EC3Esing1.52Å1.50Å
C4EO4Esing1.44Å1.42Å
C4EH4Esing1.10Å1.10Å
O4EC1Esing1.44Å1.42Å
C3EC2Esing1.52Å1.48Å
C3EO3Esing1.41Å1.41Å
C3EH3CBsing1.10Å1.10Å
O3EH3OBsing0.97Å0.95Å
C2EO2Esing1.43Å1.42Å
C2EC1Esing1.53Å1.51Å
C2EH2CBsing1.09Å1.10Å
O2EH2OBsing0.97Å0.95Å
C1EN9Bsing1.46Å1.48Å
C1EH1Esing1.10Å1.10Å
N9BC8Bsing1.37Å1.33ÅAromatic
N9BC4Bsing1.37Å1.33ÅAromatic
C8BN7Bdoub1.32Å1.34ÅAromatic
C8BH8Bsing1.08Å1.08Å
N7BC5Bsing1.37Å1.33ÅAromatic
C5BC6Bdoub1.39Å1.38ÅAromatic
C5BC4Bsing1.39Å1.38ÅAromatic
C6BN6Bsing1.41Å1.35Å
C6BN1Bsing1.35Å1.33ÅAromatic
N6BH6B1sing1.00Å1.00Å
N6BH6B2sing1.00Å1.00Å
N1BC2Bdoub1.36Å1.33ÅAromatic
C2BN3Bsing1.35Å1.33ÅAromatic
C2BH2Bsing1.08Å1.08Å
N3BC4Bdoub1.34Å1.34ÅAromatic
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O5DPAO3A99.7°102.9°
O5DPAO2A113.6°115.1°
O5DPAO1A99.6°104.7°
PAO5DC5D120.4°120.0°
O3APAO2A115.3°114.6°
O3APAO1A94.0°103.6°
PAO3APB136.1°131.0°
O2APAO1A129.4°114.4°
PAO1AHO1A109.5°118.9°
O3APBO5E97.4°101.1°
O3APBO1B115.4°115.1°
O3APBO2B122.7°103.4°
O5EPBO1B104.6°116.1°
O5EPBO2B92.7°104.3°
PBO5EC5E119.8°118.5°
O1BPBO2B116.0°115.0°
PBO2BHO2B109.5°119.0°
O5DC5DC4D108.4°109.0°
O5DC5DHD1109.8°108.8°
O5DC5DHD2110.1°108.8°
C4DC5DHD1109.8°110.5°
C4DC5DHD2110.1°110.5°
C5DC4DO4D109.1°108.4°
C5DC4DC3D113.5°113.0°
C5DC4DH4D106.0°109.3°
HD1C5DHD2108.6°109.1°
O4DC4DC3D106.4°106.5°
O4DC4DH4D113.2°107.6°
C4DO4DC1D106.5°108.8°
C3DC4DH4D108.8°112.0°
C4DC3DC2D105.4°102.3°
C4DC3DO3D108.0°108.8°
C4DC3DH3CA114.1°114.5°
O4DC1DC2D105.3°106.2°
O4DC1DN9A109.3°109.7°
O4DC1DH1D115.1°108.9°
C2DC3DO3D112.4°109.5°
C2DC3DH3CA109.8°113.8°
C3DC2DC1D101.6°101.5°
C3DC2DO2D112.9°113.0°
C3DC2DH2CA113.1°110.3°
O3DC3DH3CA107.3°107.7°
C3DO3DH3OA109.5°106.3°
C1DC2DO2D111.3°111.9°
C1DC2DH2CA114.6°111.1°
C2DC1DN9A116.7°114.1°
C2DC1DH1D107.4°112.6°
O2DC2DH2CA103.7°108.9°
C2DO2DH2OA109.5°107.3°
N9AC1DH1D103.3°105.3°
C1DN9AC8A129.7°126.1°
C1DN9AC4A120.8°126.9°
C8AN9AC4A109.4°107.0°
N9AC8AN7A108.1°112.2°
N9AC8AH8A125.9°122.2°
N9AC4AC5A107.5°105.3°
N9AC4AN3A131.5°127.5°
N7AC8AH8A126.0°125.5°
C8AN7AC5A108.3°104.9°
N7AC5AC6A135.7°132.4°
N7AC5AC4A106.7°110.7°
C6AC5AC4A117.6°116.9°
C5AC6AN6A122.5°120.7°
C5AC6AN1A118.6°119.1°
C5AC4AN3A121.0°127.2°
N6AC6AN1A118.8°120.2°
C6AN6AH6A1109.5°119.4°
C6AN6AH6A2109.5°119.4°
C6AN1AC2A122.3°117.5°
H6A1N6AH6A2109.5°120.9°
N1AC2AN3A120.8°128.8°
N1AC2AH2A119.6°115.6°
N3AC2AH2A119.6°115.6°
C2AN3AC4A119.6°110.5°
O5EC5EC4E109.3°109.0°
O5EC5EHE1109.5°108.9°
O5EC5EHE2109.5°108.8°
C4EC5EHE1109.5°110.6°
C4EC5EHE2109.6°110.5°
C5EC4EC3E109.8°113.5°
C5EC4EO4E111.3°109.8°
C5EC4EH4E106.8°108.7°
HE1C5EHE2109.4°109.1°
C3EC4EO4E105.2°105.2°
C3EC4EH4E112.7°111.2°
C4EC3EC2E104.1°102.2°
C4EC3EO3E105.4°112.1°
C4EC3EH3CB113.2°110.2°
O4EC4EH4E111.2°108.3°
C4EO4EC1E110.5°108.4°
O4EC1EC2E103.2°107.6°
O4EC1EN9B110.1°109.4°
O4EC1EH1E113.9°108.3°
C2EC3EO3E102.2°113.5°
C2EC3EH3CB115.9°109.5°
C3EC2EO2E103.9°111.2°
C3EC2EC1E101.0°102.8°
C3EC2EH2CB118.4°112.6°
O3EC3EH3CB114.8°109.1°
C3EO3EH3OB109.5°106.4°
O2EC2EC1E110.8°109.2°
O2EC2EH2CB109.8°106.9°
C2EO2EH2OB109.5°107.2°
C1EC2EH2CB112.3°114.0°
C2EC1EN9B111.5°113.7°
C2EC1EH1E112.5°112.5°
N9BC1EH1E105.9°105.1°
C1EN9BC8B125.7°126.1°
C1EN9BC4B126.7°126.9°
C8BN9BC4B107.7°107.0°
N9BC8BN7B109.5°112.2°
N9BC8BH8B125.3°122.2°
N9BC4BC5B108.3°105.2°
N9BC4BN3B132.9°127.5°
N7BC8BH8B125.3°125.6°
C8BN7BC5B107.7°104.9°
N7BC5BC6B133.4°132.4°
N7BC5BC4B106.8°110.7°
C6BC5BC4B119.8°116.9°
C5BC6BN6B121.7°120.7°
C5BC6BN1B118.7°119.1°
C5BC4BN3B118.9°127.2°
N6BC6BN1B119.6°120.2°
C6BN6BH6B1109.5°119.5°
C6BN6BH6B2109.5°119.4°
C6BN1BC2B120.5°117.5°
H6B1N6BH6B2109.4°120.8°
N1BC2BN3B122.1°128.8°
N1BC2BH2B119.0°115.5°
N3BC2BH2B118.9°115.7°
C2BN3BC4B120.1°110.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O5DPAO3AO2A122.1°125.8°
O5DPAO3AO1A100.4°108.9°
O5DPAO2AO1A126.5°121.4°
O5DPAO1AHO1A107.9°173.0°
O5DPAO3APB130.1°174.3°
PAO5DC5DC4D110.6°180.0°
PAO5DC5DHD19.4°59.4°
PAO5DC5DHD2129.0°59.4°
O3APAO2AO1A119.3°119.5°
O3APAO1AHO1A151.6°79.4°
PAO3APBO5E149.9°174.0°
PAO3APBO1B100.0°60.0°
PAO3APBO2B51.8°66.2°
O3APAO5DC5D170.3°54.6°
O2APAO1AHO1A23.8°46.1°
O2APAO3APB107.9°60.0°
O2APAO5DC5D47.1°180.0°
O1APAO3APB29.6°65.4°
O1APAO5DC5D93.9°53.5°
O3APBO5EO1B118.7°125.3°
O3APBO5EO2B123.5°107.1°
O3APBO1BO2B153.8°120.0°
O3APBO2BHO2B64.4°77.7°
O3APBO5EC5E24.1°65.2°
O5EPBO1BO2B100.4°122.2°
O5EPBO2BHO2B165.0°176.9°
PBO5EC5EC4E111.2°150.0°
PBO5EC5EHE1128.8°89.4°
PBO5EC5EHE28.9°29.4°
O1BPBO2BHO2B87.4°48.5°
O1BPBO5EC5E94.7°60.1°
O2BPBO5EC5E147.6°172.3°
O5DC5DC4DHD1120.0°119.5°
O5DC5DC4DHD2120.4°119.6°
O5DC5DHD1HD2120.4°118.6°
O5DC5DC4DO4D48.9°61.8°
O5DC5DC4DC3D69.5°179.5°
O5DC5DC4DH4D171.1°55.1°
C4DC5DHD1HD2120.5°121.7°
C5DC4DO4DC3D122.8°121.8°
C5DC4DO4DH4D117.8°118.0°
C5DC4DC3DH4D117.8°123.9°
C5DC4DO4DC1D150.5°114.3°
C5DC4DC3DC2D125.2°90.2°
C5DC4DC3DO3D114.5°154.0°
C5DC4DC3DH3CA4.7°33.4°
HD1C5DC4DO4D168.9°57.7°
HD1C5DC4DC3D50.5°60.0°
HD1C5DC4DH4D68.9°174.6°
HD2C5DC4DO4D71.5°178.6°
HD2C5DC4DC3D170.0°60.9°
HD2C5DC4DH4D50.7°64.5°
O4DC4DC3DH4D122.2°117.3°
O4DC4DC3DC2D5.2°28.6°
O4DC4DC3DO3D125.5°87.1°
O4DC4DC3DH3CA115.3°152.3°
C4DO4DC1DC2D39.7°16.9°
C4DO4DC1DN9A165.8°140.6°
C4DO4DC1DH1D78.5°104.6°
C3DC4DO4DC1D27.7°7.5°
C4DC3DC2DO3D117.4°115.3°
C4DC3DC2DH3CA123.3°124.1°
C4DC3DO3DH3CA123.4°124.7°
C4DC3DO3DH3OA37.1°56.9°
C4DC3DC2DC1D17.2°37.4°
C4DC3DC2DO2D136.6°157.5°
C4DC3DC2DH2CA106.1°80.4°
H4DC4DO4DC1D91.7°127.7°
H4DC4DC3DC2D117.0°145.9°
H4DC4DC3DO3D3.3°30.2°
H4DC4DC3DH3CA122.5°90.5°
O4DC1DC2DC3D34.5°34.2°
O4DC1DC2DN9A121.4°120.9°
O4DC1DC2DH1D123.2°119.1°
O4DC1DC2DO2D154.9°155.1°
O4DC1DC2DH2CA87.8°83.0°
O4DC1DN9AH1D123.0°117.1°
O4DC1DN9AC8A70.3°32.9°
O4DC1DN9AC4A107.8°147.0°
C2DC3DO3DH3CA120.8°124.3°
C2DC3DO3DH3OA78.8°168.0°
C3DC2DC1DO2D120.5°120.8°
C3DC2DC1DH2CA122.3°117.2°
C3DC2DO2DH2CA122.8°122.9°
C3DC2DO2DH2OA102.8°37.7°
C3DC2DC1DN9A155.9°155.1°
C3DC2DC1DH1D88.7°84.9°
O3DC3DC2DC1D100.1°77.9°
O3DC3DC2DO2D19.2°42.1°
O3DC3DC2DH2CA136.5°164.3°
H3CAC3DO3DH3OA160.4°67.8°
H3CAC3DC2DC1D140.5°161.5°
H3CAC3DC2DO2D100.2°78.5°
H3CAC3DC2DH2CA17.2°43.7°
C1DC2DO2DH2CA123.7°123.2°
C1DC2DO2DH2OA10.7°76.2°
C2DC1DN9AH1D117.6°124.0°
C2DC1DN9AC8A49.0°86.0°
C2DC1DN9AC4A132.9°94.1°
O2DC2DC1DN9A83.6°84.0°
O2DC2DC1DH1D31.7°35.9°
H2CAC2DO2DH2OA134.5°160.6°
H2CAC2DC1DN9A33.6°37.9°
H2CAC2DC1DH1D149.0°157.9°
C1DN9AC8AC4A178.3°179.9°
C1DN9AC8AN7A179.3°180.0°
C1DN9AC8AH8A0.7°0.1°
C1DN9AC4AC5A179.4°180.0°
C1DN9AC4AN3A1.6°0.1°
H1DC1DN9AC8A166.7°150.0°
H1DC1DN9AC4A15.2°29.9°
N9AC8AN7AH8A180.0°179.9°
N9AC8AN7AC5A0.6°0.1°
C8AN9AC4AC5A1.0°0.0°
C8AN9AC4AN3A180.0°180.0°
C4AN9AC8AN7A1.0°0.1°
C4AN9AC8AH8A179.0°180.0°
N9AC4AC5AN7A0.6°0.0°
N9AC4AC5AC6A179.5°180.0°
N9AC4AC5AN3A179.1°180.0°
N9AC4AN3AC2A179.3°179.9°
C8AN7AC5AC6A179.8°180.0°
C8AN7AC5AC4A0.0°0.0°
H8AC8AN7AC5A179.4°180.0°
N7AC5AC6AC4A179.8°179.9°
N7AC5AC6AN6A0.2°0.1°
N7AC5AC6AN1A180.0°180.0°
N7AC5AC4AN3A179.7°180.0°
C5AC6AN6AN1A179.7°180.0°
C5AC6AN6AH6A187.5°162.1°
C5AC6AN6AH6A2152.5°11.6°
C5AC6AN1AC2A0.2°0.0°
C6AC5AC4AN3A0.4°0.0°
C4AC5AC6AN6A179.6°180.0°
C4AC5AC6AN1A0.1°0.0°
C5AC4AN3AC2A0.4°0.1°
C6AN6AH6A1H6A2120.0°173.7°
N6AC6AN1AC2A179.9°180.0°
N1AC6AN6AH6A192.8°17.9°
N1AC6AN6AH6A227.2°168.3°
C6AN1AC2AN3A0.2°0.1°
C6AN1AC2AH2A179.8°179.9°
N1AC2AN3AH2A180.0°179.8°
N1AC2AN3AC4A0.1°0.1°
H2AC2AN3AC4A179.9°179.9°
O5EC5EC4EHE1120.0°119.6°
O5EC5EC4EHE2120.1°119.5°
O5EC5EHE1HE2120.1°118.6°
O5EC5EC4EC3E116.5°179.6°
O5EC5EC4EO4E127.4°62.2°
O5EC5EC4EH4E5.9°56.1°
C4EC5EHE1HE2120.1°121.8°
C5EC4EC3EO4E119.9°120.0°
C5EC4EC3EH4E118.9°122.9°
C5EC4EO4EH4E118.9°118.6°
C5EC4EO4EC1E122.4°148.9°
C5EC4EC3EC2E98.2°157.1°
C5EC4EC3EO3E154.6°81.0°
C5EC4EC3EH3CB28.4°40.7°
HE1C5EC4EC3E3.4°60.0°
HE1C5EC4EO4E112.7°57.4°
HE1C5EC4EH4E125.9°175.7°
HE2C5EC4EC3E123.4°61.0°
HE2C5EC4EO4E7.3°178.3°
HE2C5EC4EH4E114.2°63.3°
C3EC4EO4EH4E122.3°119.0°
C3EC4EO4EC1E3.5°26.4°
C4EC3EC2EO3E109.5°120.9°
C4EC3EC2EH3CB124.9°116.9°
C4EC3EO3EH3CB125.2°122.4°
C4EC3EO3EH3OB157.6°67.0°
C4EC3EC2EO2E151.5°84.0°
C4EC3EC2EC1E36.7°32.8°
C4EC3EC2EH2CB86.4°155.9°
O4EC4EC3EC2E21.6°37.1°
O4EC4EC3EO3E85.5°159.0°
O4EC4EC3EH3CB148.3°79.3°
C4EO4EC1EC2E26.8°5.1°
C4EO4EC1EN9B145.8°129.0°
C4EO4EC1EH1E95.5°116.9°
H4EC4EO4EC1E118.7°92.6°
H4EC4EC3EC2E142.9°80.0°
H4EC4EC3EO3E35.8°41.9°
H4EC4EC3EH3CB90.4°163.6°
O4EC1EC2EC3E38.7°18.1°
O4EC1EC2EO2E148.3°100.1°
O4EC1EC2EN9B118.1°121.4°
O4EC1EC2EH1E123.1°119.2°
O4EC1EC2EH2CB88.5°140.4°
O4EC1EN9BH1E123.5°116.1°
O4EC1EN9BC8B75.2°34.0°
O4EC1EN9BC4B104.4°146.1°
C2EC3EO3EH3CB126.3°122.4°
C2EC3EO3EH3OB49.1°177.8°
C3EC2EO2EC1E107.7°112.8°
C3EC2EO2EH2CB127.6°123.4°
C3EC2EC1EH2CB127.2°122.2°
C3EC2EO2EH2OB101.5°56.2°
C3EC2EC1EN9B156.9°103.2°
C3EC2EC1EH1E84.4°137.4°
O3EC3EC2EO2E42.0°36.9°
O3EC3EC2EC1E72.9°153.7°
O3EC3EC2EH2CB164.1°83.1°
H3CBC3EO3EH3OB77.2°55.4°
H3CBC3EC2EO2E83.6°159.1°
H3CBC3EC2EC1E161.6°84.1°
H3CBC3EC2EH2CB38.5°39.0°
O2EC2EC1EH2CB123.2°119.5°
O2EC2EC1EN9B93.6°138.5°
O2EC2EC1EH1E25.2°19.1°
C1EC2EO2EH2OB150.8°169.0°
C2EC1EN9BH1E122.7°123.5°
C2EC1EN9BC8B38.7°86.4°
C2EC1EN9BC4B141.7°93.6°
H2CBC2EO2EH2OB26.1°67.2°
H2CBC2EC1EN9B29.7°19.0°
H2CBC2EC1EH1E148.4°100.4°
C1EN9BC8BC4B179.7°180.0°
C1EN9BC8BN7B179.7°180.0°
C1EN9BC8BH8B0.2°0.1°
C1EN9BC4BC5B179.9°180.0°
C1EN9BC4BN3B0.2°0.1°
H1EC1EN9BC8B161.3°150.1°
H1EC1EN9BC4B19.1°30.0°
N9BC8BN7BH8B180.0°179.9°
N9BC8BN7BC5B0.5°0.0°
C8BN9BC4BC5B0.4°0.0°
C8BN9BC4BN3B179.5°179.9°
C4BN9BC8BN7B0.6°0.0°
C4BN9BC8BH8B179.5°180.0°
N9BC4BC5BN7B0.1°0.0°
N9BC4BC5BC6B179.9°180.0°
N9BC4BC5BN3B180.0°179.9°
N9BC4BN3BC2B179.7°180.0°
C8BN7BC5BC6B179.8°180.0°
C8BN7BC5BC4B0.2°0.0°
H8BC8BN7BC5B179.5°180.0°
N7BC5BC6BC4B180.0°180.0°
N7BC5BC6BN6B0.1°0.0°
N7BC5BC6BN1B179.7°180.0°
N7BC5BC4BN3B179.8°179.9°
C5BC6BN6BN1B179.6°180.0°
C5BC6BN6BH6B175.7°104.8°
C5BC6BN6BH6B2164.3°68.9°
C5BC6BN1BC2B0.5°0.0°
C6BC5BC4BN3B0.2°0.1°
C4BC5BC6BN6B179.9°179.9°
C4BC5BC6BN1B0.2°0.1°
C5BC4BN3BC2B0.3°0.1°
C6BN6BH6B1H6B2120.0°173.6°
N6BC6BN1BC2B179.9°180.0°
N1BC6BN6BH6B1104.6°75.2°
N1BC6BN6BH6B215.4°111.1°
C6BN1BC2BN3B0.7°0.1°
C6BN1BC2BH2B179.3°179.9°
N1BC2BN3BH2B180.0°180.0°
N1BC2BN3BC4B0.6°0.1°
H2BC2BN3BC4B179.4°179.9°

225946

PDB entries from 2024-10-09

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