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NU9

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
F01C02sing1.40Å1.33Å
C02F03sing1.40Å1.33Å
C02F04sing1.40Å1.33Å
C02C05sing1.51Å1.49Å
C05N06doub1.31Å1.35ÅAromatic
C05O09sing1.34Å1.38ÅAromatic
N06C07sing1.35Å1.40ÅAromatic
C07N08doub1.31Å1.36ÅAromatic
C07C10sing1.48Å1.39Å
N08O09sing1.21Å1.39ÅAromatic
C10C11doub1.39Å1.40ÅAromatic
C10C15sing1.39Å1.40ÅAromatic
C11C12sing1.38Å1.40ÅAromatic
C12C13doub1.38Å1.40ÅAromatic
C13C14sing1.40Å1.40ÅAromatic
C14C15doub1.39Å1.40ÅAromatic
C14C16sing1.48Å1.49Å
C16O17doub1.22Å1.22Å
C16N18sing1.35Å1.43Å
N18C19sing1.47Å1.44Å
C19C20sing1.53Å1.55Å
C20C21sing1.53Å1.50Å
C20C25sing1.53Å1.50Å
C20C26sing1.51Å1.51Å
C21C22sing1.53Å1.53Å
C22O23sing1.43Å1.44Å
O23C24sing1.43Å1.44Å
C24C25sing1.53Å1.53Å
C26N27doub1.29Å1.48ÅAromatic
C26S30sing1.71Å1.54ÅAromatic
N27C28sing1.33Å1.63ÅAromatic
C28C29doub1.35Å1.44ÅAromatic
C28C31sing1.48Å1.39Å
C29S30sing1.76Å1.61ÅAromatic
C31C32doub1.39Å1.40ÅAromatic
C31C36sing1.39Å1.40ÅAromatic
C32C33sing1.38Å1.40ÅAromatic
C33C34doub1.38Å1.40ÅAromatic
C34C35sing1.38Å1.40ÅAromatic
C35C36doub1.38Å1.40ÅAromatic
C11H11sing1.08Å1.08Å
C12H12sing1.08Å1.08Å
C13H13sing1.08Å1.08Å
C15H15sing1.08Å1.08Å
N18HN18sing0.97Å1.00Å
C19H19sing1.09Å1.10Å
C19H19Asing1.09Å1.10Å
C21H21sing1.09Å1.10Å
C21H21Asing1.09Å1.10Å
C22H22sing1.09Å1.10Å
C22H22Asing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C24H24Asing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C25H25Asing1.09Å1.10Å
C29H29sing1.08Å1.08Å
C32H32sing1.08Å1.08Å
C33H33sing1.08Å1.08Å
C34H34sing1.08Å1.08Å
C35H35sing1.08Å1.08Å
C36H36sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
F01C02F03110.1°109.4°
F01C02F04109.4°109.5°
F01C02C05109.7°109.5°
F03C02F04109.9°109.5°
F03C02C05108.5°109.5°
F04C02C05109.3°109.5°
C02C05N06125.8°126.4°
C02C05O09126.1°126.4°
N06C05O09108.2°107.1°
C05N06C07108.3°105.6°
C05O09N08107.7°110.0°
N06C07N08107.5°107.2°
N06C07C10125.6°126.4°
N08C07C10126.6°126.4°
C07N08O09108.3°110.1°
C07C10C11120.3°120.1°
C07C10C15120.4°120.0°
C11C10C15119.3°119.9°
C10C11C12120.1°120.2°
C10C11H11120.0°119.9°
C10C15C14120.3°119.7°
C10C15H15119.9°120.2°
C11C12C13120.4°120.3°
C12C11H11119.9°119.9°
C11C12H12119.8°119.8°
C12C13C14119.5°120.1°
C13C12H12119.8°119.9°
C12C13H13120.3°119.9°
C13C14C15120.3°119.9°
C13C14C16120.4°120.0°
C14C13H13120.2°120.0°
C15C14C16119.2°120.1°
C14C15H15119.8°120.1°
C14C16O17122.1°120.0°
C14C16N18115.1°120.0°
O17C16N18122.8°120.0°
C16N18C19124.4°120.0°
C16N18HN18117.8°120.1°
N18C19C20117.1°109.5°
C19N18HN18117.8°119.9°
N18C19H19107.5°109.4°
N18C19H19A107.5°109.5°
C19C20C21102.6°109.5°
C19C20C25103.5°109.5°
C19C20C26101.5°109.6°
C20C19H19107.5°109.5°
C20C19H19A107.5°109.5°
C21C20C25111.9°109.0°
C21C20C26116.1°109.6°
C20C21C22112.6°109.2°
C20C21H21108.7°109.5°
C20C21H21A108.7°109.5°
C25C20C26118.2°109.6°
C20C25C24112.4°109.2°
C20C25H25108.7°109.5°
C20C25H25A108.7°109.5°
C20C26N27124.6°124.8°
C20C26S30128.6°124.7°
C21C22O23113.5°109.4°
C22C21H21108.7°109.5°
C22C21H21A108.7°109.5°
C21C22H22108.5°109.5°
C21C22H22A108.4°109.5°
C22O23C24114.3°114.1°
O23C22H22108.5°109.4°
O23C22H22A108.5°109.5°
O23C24C25113.8°109.4°
O23C24H24108.4°109.5°
O23C24H24A108.4°109.5°
C25C24H24108.4°109.5°
C25C24H24A108.4°109.5°
C24C25H25108.7°109.5°
C24C25H25A108.7°109.6°
N27C26S30106.8°110.5°
C26N27C28109.8°117.1°
C26S30C29108.1°90.4°
N27C28C29107.1°114.1°
N27C28C31124.5°123.0°
C29C28C31128.5°123.0°
C28C29S30108.3°107.9°
C28C29H29125.9°126.1°
C28C31C32121.4°120.1°
C28C31C36119.3°120.1°
S30C29H29125.9°126.1°
C32C31C36119.2°119.8°
C31C32C33120.5°119.9°
C31C32H32119.8°120.1°
C31C36C35120.4°119.9°
C31C36H36119.8°120.1°
C32C33C34120.1°120.1°
C33C32H32119.8°120.0°
C32C33H33120.0°119.9°
C33C34C35119.7°120.3°
C34C33H33119.9°120.0°
C33C34H34120.1°119.8°
C34C35C36120.1°120.1°
C35C34H34120.2°119.9°
C34C35H35119.9°119.9°
C36C35H35119.9°120.0°
C35C36H36119.8°120.0°
H19C19H19A109.5°109.4°
H21C21H21A109.5°109.6°
H22C22H22A109.5°109.5°
H24C24H24A109.4°109.5°
H25C25H25A109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
F01C02F03F04120.5°120.0°
F01C02F03C05120.1°120.0°
F01C02F04C05120.2°120.0°
F01C02C05N066.6°89.9°
F01C02C05O09174.8°90.3°
F03C02F04C05118.9°120.0°
F03C02C05N06113.7°30.0°
F03C02C05O0964.9°149.7°
F04C02C05N06126.5°150.0°
F04C02C05O0954.9°29.7°
C02C05N06O09178.8°179.8°
C02C05N06C07178.3°180.0°
C02C05O09N08179.7°179.8°
C05N06C07N081.7°0.0°
C05N06C07C10176.4°180.0°
N06C05O09N080.9°0.4°
O09C05N06C070.5°0.2°
C05O09N08C071.9°0.4°
N06C07N08C10174.6°180.0°
N06C07N08O092.3°0.3°
N06C07C10C115.2°0.0°
N06C07C10C15174.2°179.7°
N08C07C10C11178.8°180.0°
N08C07C10C150.6°0.3°
C10C07N08O09176.8°179.8°
C07C10C11C15179.4°179.7°
C07C10C11C12179.6°180.0°
C07C10C15C14179.9°179.6°
C07C10C11H110.5°0.0°
C07C10C15H150.2°0.0°
C10C11C12H11180.0°180.0°
C10C11C12C130.1°0.0°
C11C10C15C140.8°0.6°
C10C11C12H12179.9°179.9°
C11C10C15H15179.2°179.8°
C15C10C11C120.2°0.3°
C10C15C14C131.1°0.7°
C10C15C14H15180.0°179.6°
C10C15C14C16179.2°179.6°
C15C10C11H11179.8°179.7°
C11C12C13H12180.0°180.0°
C11C12C13C140.3°0.0°
C11C12C13H13179.7°180.0°
C12C13C14H13180.0°179.9°
C12C13C14C150.9°0.3°
C12C13C14C16178.9°180.0°
C13C12C11H11179.9°180.0°
C13C14C15C16178.1°179.7°
C13C14C16O1756.0°180.0°
C13C14C16N18123.4°0.1°
C14C13C12H12179.7°180.0°
C13C14C15H15178.9°179.7°
C15C14C16O17126.0°0.3°
C15C14C16N1854.7°179.6°
C15C14C13H13179.1°179.6°
C14C16O17N18179.3°179.9°
C14C16N18C19179.5°180.0°
C16C14C13H131.1°0.1°
C16C14C15H150.8°0.0°
C14C16N18HN180.5°0.0°
O17C16N18C190.1°0.1°
O17C16N18HN18179.9°180.0°
C16N18C19HN18180.0°179.9°
C16N18C19C20150.3°180.0°
C16N18C19H1929.2°60.0°
C16N18C19H19A88.6°59.9°
N18C19C20H19121.1°119.9°
N18C19C20H19A121.1°120.0°
N18C19C20C2156.6°180.0°
N18C19C20C25173.1°60.5°
N18C19C20C2663.8°59.8°
N18C19H19H19A116.5°120.0°
C19C20C21C25110.4°119.8°
C19C20C21C26109.8°120.2°
C19C20C25C26111.2°120.2°
C19C20C21C22156.5°62.8°
C19C20C25C24160.6°62.8°
C19C20C26N2764.6°60.0°
C19C20C26S30116.1°119.7°
C20C19N18HN1829.7°0.0°
C20C19H19H19A116.6°120.1°
C19C20C21H2183.0°177.3°
C19C20C21H21A36.1°57.0°
C19C20C25H2540.2°57.1°
C19C20C25H25A78.9°177.2°
C21C20C25C26138.9°119.9°
C20C21C22H21120.5°119.9°
C20C21C22H21A120.5°119.9°
C20C21C22O234.5°57.7°
C21C20C25C2450.8°57.0°
C21C20C26N2745.9°179.8°
C21C20C26S30133.5°0.4°
C21C20C19H1964.5°60.1°
C21C20C19H19A177.7°60.0°
C20C21H21H21A118.6°120.2°
C20C21C22H22125.1°177.6°
C20C21C22H22A116.1°62.4°
C21C20C25H2569.6°176.9°
C21C20C25H25A171.2°63.0°
C25C20C21C2246.1°57.0°
C20C25C24O234.2°57.6°
C20C25C24H25120.5°119.9°
C20C25C24H25A120.4°119.9°
C25C20C26N27176.9°60.2°
C25C20C26S303.8°120.1°
C25C20C19H1952.0°179.6°
C25C20C19H19A65.8°59.5°
C25C20C21H21166.6°62.9°
C25C20C21H21A74.3°176.8°
C20C25C24H24116.4°177.6°
C20C25C24H24A124.8°62.4°
C20C25H25H25A118.7°120.1°
C26C20C21C2293.7°177.0°
C26C20C25C2488.1°176.9°
C20C26N27S30179.4°179.8°
C20C26N27C28177.9°180.0°
C20C26S30C29178.5°179.9°
C26C20C19H19175.1°60.2°
C26C20C19H19A57.2°179.8°
C26C20C21H2126.8°57.1°
C26C20C21H21A145.9°63.2°
C26C20C25H25151.4°63.1°
C26C20C25H25A32.3°57.0°
C21C22O23H22120.6°119.9°
C21C22O23H22A120.6°120.0°
C21C22O23C2453.5°61.2°
C22C21H21H21A118.6°120.2°
C21C22H22H22A118.2°120.1°
C22O23C24C2548.7°61.2°
O23C22C21H21115.9°62.3°
O23C22C21H21A125.0°177.5°
O23C22H22H22A118.2°120.0°
C22O23C24H24169.3°178.9°
C22O23C24H24A72.0°58.8°
O23C24C25H24120.6°120.0°
O23C24C25H24A120.7°120.0°
C24O23C22H22174.0°178.9°
C24O23C22H22A67.1°58.8°
O23C24H24H24A118.1°120.1°
O23C24C25H25116.3°177.5°
O23C24C25H25A124.6°62.3°
C25C24H24H24A118.0°120.0°
C24C25H25H25A118.6°120.2°
C26N27C28C292.3°0.1°
C26N27C28C31178.1°180.0°
N27C26S30C292.1°0.3°
S30C26N27C282.6°0.2°
C26S30C29C280.7°0.3°
C26S30C29H29179.3°180.0°
N27C28C29C31179.6°179.9°
N27C28C29S300.9°0.3°
N27C28C31C32157.8°175.0°
N27C28C31C3622.1°4.8°
N27C28C29H29179.1°180.0°
C28C29S30H29180.0°179.7°
C29C28C31C3221.7°4.9°
C29C28C31C36158.4°175.3°
C31C28C29S30179.5°179.8°
C28C31C32C36179.9°179.8°
C28C31C32C33179.9°180.0°
C28C31C36C35180.0°179.8°
C31C28C29H290.5°0.1°
C28C31C32H320.1°0.0°
C28C31C36H360.0°0.1°
C31C32C33H32180.0°180.0°
C31C32C33C340.2°0.0°
C32C31C36C350.1°0.4°
C31C32C33H33179.8°180.0°
C32C31C36H36179.9°179.7°
C36C31C32C330.2°0.2°
C31C36C35C340.1°0.5°
C31C36C35H36180.0°179.9°
C36C31C32H32179.8°179.8°
C31C36C35H35180.0°179.7°
C32C33C34H33180.0°180.0°
C32C33C34C350.1°0.0°
C32C33C34H34179.9°180.0°
C33C34C35H34180.0°179.9°
C33C34C35C360.0°0.2°
C34C33C32H32179.8°180.0°
C33C34C35H35180.0°179.9°
C34C35C36H35180.0°179.8°
C35C34C33H33179.9°180.0°
C34C35C36H36179.9°179.7°
C36C35C34H34180.0°179.8°
H11C11C12H120.1°0.0°
H12C12C13H130.3°0.0°
HN18N18C19H19150.8°120.0°
HN18N18C19H19A91.4°120.0°
H21C21C22H224.7°57.6°
H21C21C22H22A123.5°177.7°
H21AC21C22H22114.4°62.6°
H21AC21C22H22A4.4°57.5°
H24C24C25H25123.1°62.5°
H24C24C25H25A4.0°57.6°
H24AC24C25H254.4°57.5°
H24AC24C25H25A114.7°177.7°
H32C32C33H330.2°0.0°
H33C33C34H340.1°0.0°
H34C34C35H350.0°0.0°
H35C35C36H360.1°0.1°

222415

PDB entries from 2024-07-10

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