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81B

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O10C03doub1.21Å1.19Å
O01C02doub1.21Å1.26Å
C03C02sing1.49Å1.52Å
C03N04sing1.35Å1.45Å
C02O11sing1.35Å1.27Å
N04C05sing1.47Å1.45Å
C06C05sing1.54Å1.67Å
C06C07sing1.55Å1.38Å
C05C09sing1.54Å1.37Å
C07C08sing1.55Å1.59Å
C09C08sing1.54Å1.58Å
C05H1sing1.09Å1.10Å
C06H2sing1.09Å1.10Å
C06H3sing1.09Å1.10Å
C07H4sing1.09Å1.10Å
C07H5sing1.09Å1.10Å
C08H6sing1.09Å1.10Å
C08H7sing1.09Å1.10Å
C09H8sing1.09Å1.10Å
C09H9sing1.09Å1.10Å
N04H10sing0.97Å1.00Å
O11H11sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O10C03C02116.0°120.0°
O10C03N04119.2°120.0°
O01C02C03114.1°120.0°
O01C02O11122.9°120.0°
C02C03N04124.8°120.0°
C03C02O11122.9°120.0°
C03N04C05126.1°120.0°
C03N04H10116.9°120.0°
C02O11H11109.5°117.0°
N04C05C06112.7°110.1°
N04C05C09104.4°110.0°
N04C05H1111.8°110.0°
C05N04H10116.9°120.0°
C05C06C07108.1°104.2°
C06C05C09105.6°106.6°
C06C05H1108.9°110.1°
C05C06H2109.8°110.5°
C05C06H3109.8°110.5°
C06C07C08106.1°102.7°
C07C06H2109.8°110.5°
C07C06H3109.8°110.5°
C06C07H4110.3°110.8°
C06C07H5110.3°110.8°
C05C09C08104.7°106.6°
C09C05H1113.3°110.0°
C05C09H8110.6°110.0°
C05C09H9110.6°110.0°
C07C08C09104.3°104.2°
C08C07H4110.3°110.7°
C08C07H5110.3°110.7°
C07C08H6110.7°110.5°
C07C08H7110.7°110.5°
C09C08H6110.7°110.5°
C09C08H7110.7°110.6°
C08C09H8110.7°110.0°
C08C09H9110.6°110.1°
H2C06H3109.4°110.5°
H4C07H5109.5°110.8°
H6C08H7109.5°110.4°
H8C09H9109.5°110.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O10C03C02O0124.2°179.7°
O10C03C02N04178.6°179.9°
O10C03C02O11152.7°0.1°
O10C03N04C05176.7°0.1°
O10C03N04H103.3°180.0°
O01C02C03O11176.9°179.7°
O01C02C03N04157.2°0.3°
O01C02O11H110.0°0.4°
C02C03N04C054.7°180.0°
C02C03N04H10175.2°0.1°
C03C02O11H11176.6°180.0°
N04C03C02O1125.9°180.0°
C03N04C05H10180.0°180.0°
C03N04C05C06121.8°87.8°
C03N04C05C09124.1°155.0°
C03N04C05H11.3°33.6°
N04C05C06C09113.3°119.3°
N04C05C06H1124.7°121.4°
N04C05C06C07134.9°142.9°
N04C05C09H1121.9°121.3°
N04C05C09C08151.0°119.3°
N04C05C06H215.1°24.2°
N04C05C06H3105.3°98.4°
N04C05C09H889.7°121.4°
N04C05C09H931.8°0.0°
C05C06C07H2119.8°118.7°
C05C06C07H3119.8°118.7°
C06C05C09H1119.1°119.3°
C05C06C07C080.0°38.0°
C06C05C09C0832.0°0.0°
C05C06H2H3120.6°122.6°
C05C06C07H4119.5°156.2°
C05C06C07H5119.5°80.3°
C06C05C09H8151.2°119.3°
C06C05C09H987.3°119.3°
C06C05N04H1058.1°92.2°
C07C06C05C0921.5°23.6°
C06C07C08H4119.5°118.3°
C06C07C08H5119.5°118.3°
C06C07C08C0918.4°37.9°
C07C06C05H1100.4°95.7°
C07C06H2H3120.6°122.6°
C06C07H4H5121.5°123.4°
C06C07C08H6137.6°80.8°
C06C07C08H7100.8°156.8°
C05C09C08C0732.7°23.6°
C05C09C08H8119.3°119.3°
C05C09C08H9119.2°119.3°
C09C05C06H298.3°95.1°
C09C05C06H3141.3°142.3°
C05C09C08H6151.8°95.1°
C05C09C08H786.5°142.3°
C05C09H8H9122.2°121.4°
C09C05N04H1055.9°25.0°
C07C08C09H6119.2°118.7°
C07C08C09H7119.2°118.7°
C08C07C06H2119.8°80.8°
C08C07C06H3119.8°156.6°
C08C07H4H5121.6°123.3°
C07C08H6H7122.4°122.5°
C07C08C09H8151.9°95.7°
C07C08C09H986.6°142.9°
C08C09C05H187.1°119.3°
C09C08C07H4101.1°156.2°
C09C08C07H5137.9°80.4°
C09C08H6H7122.4°122.7°
C08C09H8H9122.2°121.4°
H1C05C06H2139.8°145.6°
H1C05C06H319.4°23.0°
H1C05C09H832.2°0.0°
H1C05C09H9153.7°121.4°
H1C05N04H10178.8°146.3°
H2C06C07H40.3°37.5°
H2C06C07H5120.7°160.9°
H3C06C07H4120.7°85.1°
H3C06C07H50.3°38.3°
H4C07C08H618.1°37.6°
H4C07C08H7139.7°84.9°
H5C07C08H6103.0°160.9°
H5C07C08H718.7°38.5°
H6C08C09H888.9°145.7°
H6C08C09H932.6°24.2°
H7C08C09H832.7°23.0°
H7C08C09H9154.2°98.4°

224572

PDB entries from 2024-09-04

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