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Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O16C05doub1.22Å1.19Å
C05C06sing1.48Å1.51Å
C05N04sing1.35Å1.47Å
C15C06doub1.40Å1.36ÅAromatic
C15C14sing1.38Å1.41ÅAromatic
C18C17sing1.53Å1.51Å
C18O19sing1.43Å1.42Å
C17N04sing1.47Å1.44Å
C06C07sing1.41Å1.43ÅAromatic
C14N13doub1.32Å1.33ÅAromatic
N04C03sing1.47Å1.45Å
C07C12doub1.41Å1.36ÅAromatic
C07N08sing1.35Å1.37ÅAromatic
N13C12sing1.32Å1.34ÅAromatic
O19C02sing1.43Å1.42Å
C12N11sing1.38Å1.37ÅAromatic
N08C09doub1.31Å1.33ÅAromatic
C03C02sing1.53Å1.52Å
C02C01sing1.53Å1.55Å
N11C09sing1.36Å1.33ÅAromatic
C09O10sing1.35Å1.45Å
C18H181sing1.09Å1.10Å
C18H182sing1.09Å1.10Å
C17H171sing1.09Å1.10Å
C17H172sing1.09Å1.10Å
C15H151sing1.08Å1.08Å
C14H141sing1.08Å1.08Å
C01H013sing1.09Å1.10Å
C01H011sing1.09Å1.10Å
C01H012sing1.09Å1.10Å
C02H021sing1.09Å1.10Å
C03H031sing1.09Å1.10Å
C03H032sing1.09Å1.10Å
N11H111sing0.97Å1.00Å
O10H101sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O16C05C06118.4°120.0°
O16C05N04119.0°120.0°
C06C05N04122.6°120.0°
C05C06C15123.2°121.1°
C05C06C07118.1°121.1°
C05N04C17121.5°121.0°
C05N04C03127.0°121.0°
C06C15C14117.8°119.3°
C15C06C07118.7°117.8°
C06C15H151121.1°120.3°
C15C14N13122.8°121.6°
C14C15H151121.1°120.4°
C15C14H141118.6°119.2°
C17C18O19111.3°109.2°
C18C17N04110.3°108.4°
C17C18H181109.0°109.5°
C17C18H182109.0°109.5°
C18C17H171109.2°109.6°
C18C17H172109.3°109.7°
C18O19C02113.4°114.2°
O19C18H181109.0°109.5°
O19C18H182109.0°109.5°
C17N04C03111.5°118.0°
N04C17H171109.3°109.7°
N04C17H172109.2°109.7°
C06C07C12119.5°118.8°
C06C07N08132.1°133.8°
C14N13C12119.6°122.0°
N13C14H141118.6°119.3°
N04C03C02114.0°108.4°
N04C03H031108.3°109.7°
N04C03H032108.3°109.7°
C12C07N08108.4°107.4°
C07C12N13121.6°120.5°
C07C12N11106.0°105.8°
C07N08C09107.7°109.6°
N13C12N11132.5°133.7°
O19C02C03113.9°109.2°
O19C02C01110.3°109.5°
O19C02H021109.8°109.6°
C12N11C09109.2°107.3°
C12N11H111125.4°126.4°
N08C09N11108.7°109.9°
N08C09O10124.6°125.0°
C03C02C01105.8°109.5°
C03C02H021108.6°109.5°
C02C03H031108.3°109.7°
C02C03H032108.3°109.7°
C02C01H013109.5°109.5°
C02C01H011109.4°109.5°
C02C01H012109.4°109.5°
C01C02H021108.2°109.6°
N11C09O10126.6°125.1°
C09N11H111125.4°126.3°
C09O10H101109.5°114.1°
H181C18H182109.5°109.6°
H171C17H172109.5°109.7°
H013C01H011109.5°109.5°
H013C01H012109.5°109.5°
H011C01H012109.5°109.4°
H031C03H032109.5°109.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O16C05C06N04178.2°180.0°
O16C05C06C1587.6°135.5°
O16C05N04C171.1°174.5°
O16C05C06C0791.3°44.6°
O16C05N04C03180.0°5.6°
C05C06C15C07178.8°180.0°
C05C06C15C14179.3°180.0°
C06C05N04C17179.3°5.5°
C06C05N04C031.8°174.4°
C05C06C07C12179.3°180.0°
C05C06C07N080.8°0.1°
C05C06C15H1510.6°0.3°
N04C05C06C1594.3°44.5°
C05N04C17C18122.9°129.4°
C05N04C17C03179.0°180.0°
N04C05C06C0786.9°135.4°
C05N04C03C02130.3°129.4°
C05N04C17H1712.7°9.8°
C05N04C17H172117.0°110.8°
C05N04C03H0319.7°110.8°
C05N04C03H032109.0°9.7°
C06C15C14H151180.0°179.8°
C06C15C14N130.4°0.0°
C15C06C07C120.5°0.0°
C15C06C07N08179.7°180.0°
C06C15C14H141179.6°180.0°
C14C15C06C070.5°0.0°
C15C14N13H141180.0°179.9°
C15C14N13C120.1°0.1°
C17C18O19H181120.3°119.9°
C17C18O19H182120.3°119.9°
C18C17N04H171120.1°119.7°
C18C17N04H172120.2°119.8°
C18C17N04C0356.1°50.6°
C17C18O19C0254.4°62.6°
C17C18H181H182119.2°120.1°
C18C17H171H172119.6°120.5°
O19C18C17N0459.5°52.3°
C18O19C02C0346.2°62.6°
C18O19C02C01165.1°177.5°
O19C18H181H182119.1°120.2°
O19C18C17H171179.6°172.0°
O19C18C17H17260.7°67.5°
C18O19C02H02175.8°57.3°
C17N04C03C0248.6°50.6°
N04C17C18H181179.7°172.3°
N04C17C18H18260.8°67.6°
N04C17H171H172119.6°120.6°
C17N04C03H031169.3°69.2°
C17N04C03H03272.1°170.3°
C06C07C12N08179.9°180.0°
C06C07C12N130.2°0.1°
C06C07C12N11179.8°180.0°
C06C07N08C09179.8°180.0°
C07C06C15H151179.5°179.7°
C14N13C12C070.0°0.1°
C14N13C12N11180.0°179.9°
N13C14C15H151179.6°179.8°
N04C03C02O1943.3°52.3°
N04C03C02H031120.7°119.7°
N04C03C02H032120.7°119.8°
N04C03C02C01164.7°172.2°
C03N04C17H171176.3°170.2°
C03N04C17H17264.0°69.2°
N04C03C02H02179.4°67.6°
N04C03H031H032117.9°120.5°
C07C12N13N11180.0°179.9°
C12C07N08C090.0°0.0°
C07C12N11C090.1°0.0°
C07C12N11H111179.9°179.9°
N08C07C12N13179.9°180.0°
N08C07C12N110.1°0.0°
C07N08C09N110.0°0.0°
C07N08C09O10180.0°180.0°
N13C12N11C09179.9°180.0°
C12N13C14H141179.9°180.0°
N13C12N11H1110.1°0.0°
O19C02C03C01121.4°119.9°
O19C02C03H021122.7°120.0°
O19C02C01H021120.1°120.2°
C02O19C18H181174.6°177.5°
C02O19C18H18265.9°57.3°
O19C02C01H013180.0°59.8°
O19C02C01H01160.0°60.2°
O19C02C01H01260.0°179.8°
O19C02C03H031163.9°67.4°
O19C02C03H03277.4°172.1°
C12N11C09N080.0°0.0°
C12N11C09H111180.0°179.9°
C12N11C09O10180.0°180.0°
N08C09N11O10180.0°180.0°
N08C09N11H111180.0°179.9°
N08C09O10H1010.0°90.0°
C03C02C01H021116.2°120.1°
C03C02C01H01356.3°59.9°
C03C02C01H01163.7°179.9°
C03C02C01H012176.3°60.1°
C02C03H031H032117.9°120.5°
C02C01H013H011120.0°120.0°
C02C01H013H012120.0°120.0°
C02C01H011H012119.9°119.9°
C01C02C03H03174.7°52.5°
C01C02C03H03244.0°68.0°
N11C09O10H101180.0°90.0°
O10C09N11H1110.0°0.0°
H181C18C17H17160.1°68.0°
H181C18C17H17259.6°52.5°
H182C18C17H17159.3°52.1°
H182C18C17H172179.1°172.6°
H151C15C14H1410.4°0.3°
H013C01H011H012120.0°120.0°
H013C01C02H02159.9°180.0°
H011C01C02H021179.9°60.0°
H012C01C02H02160.2°59.9°
H021C02C03H03141.2°172.6°
H021C02C03H032159.9°52.1°

223532

PDB entries from 2024-08-07

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