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Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O31C11doub1.21Å1.22Å
C11N27sing1.35Å1.33Å
C11C23sing1.51Å1.52Å
C19N27sing1.47Å1.46Å
N27C20sing1.47Å1.46Å
C20C16sing1.54Å1.52Å
C20H20sing1.09Å1.10Å
C20H20Asing1.09Å1.10Å
C15C16sing1.55Å1.52Å
C16H16sing1.09Å1.10Å
C16H16Asing1.09Å1.10Å
C19C15sing1.55Å1.53Å
C19H19sing1.09Å1.10Å
C19H19Asing1.09Å1.10Å
C15H15sing1.09Å1.10Å
C15H15Asing1.09Å1.10Å
N26C23sing1.47Å1.46Å
C23H23sing1.09Å1.10Å
C23H23Asing1.09Å1.10Å
C10N26sing1.33Å1.34Å
N26C18sing1.47Å1.47Å
C21C10sing1.51Å1.51Å
O30C10doub1.21Å1.22Å
C18C14sing1.53Å1.53Å
C18H18sing1.09Å1.10Å
C18H18Asing1.09Å1.10Å
C13C14sing1.52Å1.53Å
C14H14sing1.09Å1.10Å
C14H14Asing1.09Å1.10Å
C17C13sing1.52Å1.54Å
C13H13sing1.09Å1.10Å
C13H13Asing1.09Å1.10Å
C21C17sing1.53Å1.53Å
C17H17sing1.09Å1.10Å
C17H17Asing1.09Å1.10Å
N29C21sing1.46Å1.46Å
C21H21sing1.09Å1.10Å
C12N29sing1.37Å1.34Å
N29HN29sing0.97Å1.00Å
N28C12doub1.31Å1.35Å
N25C12sing1.38Å1.34Å
C1N25sing1.35Å1.21Å
N25HN25sing0.97Å1.00Å
N24C1trip1.14Å1.16Å
N28C7sing1.37Å1.41Å
C4C7doub1.39Å1.40ÅAromatic
C7C2sing1.40Å1.40ÅAromatic
C2C3doub1.38Å1.39ÅAromatic
C2H2sing1.08Å1.08Å
C4C6sing1.39Å1.40ÅAromatic
C4H4sing1.08Å1.08Å
C5C6sing1.47Å1.45ÅAromatic
C6C8doub1.40Å1.37ÅAromatic
C8O32sing1.35Å1.41ÅAromatic
C8C3sing1.39Å1.38ÅAromatic
C3H3sing1.08Å1.08Å
C9O32sing1.34Å1.36ÅAromatic
C5C9doub1.34Å1.40ÅAromatic
C22C9sing1.51Å1.50Å
C22H22sing1.09Å1.10Å
C22H22Asing1.09Å1.10Å
C22H22Bsing1.09Å1.10Å
C5H5sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O31C11N27122.4°120.0°
O31C11C23120.2°120.0°
N27C11C23117.4°120.0°
C11N27C19122.5°125.6°
C11N27C20123.0°125.6°
C11C23N26111.3°109.4°
C11C23H23108.9°109.5°
C11C23H23A108.5°109.5°
C19N27C20114.5°108.7°
N27C19C15104.1°104.7°
N27C19H19111.3°110.4°
N27C19H19A112.5°110.4°
N27C20C16104.5°107.2°
N27C20H20111.2°109.9°
N27C20H20A112.2°109.9°
C16C20H20111.2°109.9°
C16C20H20A112.3°109.9°
C20C16C15107.5°102.9°
C20C16H16110.1°110.7°
C20C16H16A110.5°110.7°
H20C20H20A105.7°110.0°
C15C16H16110.1°110.7°
C15C16H16A110.6°110.9°
C16C15C19107.3°101.5°
C16C15H15110.2°111.3°
C16C15H15A110.7°110.8°
H16C16H16A108.0°110.6°
C15C19H19111.3°110.5°
C15C19H19A112.4°110.3°
C19C15H15110.2°111.0°
C19C15H15A110.7°111.0°
H19C19H19A105.4°110.4°
H15C15H15A107.7°110.9°
N26C23H23108.9°109.4°
N26C23H23A108.4°109.5°
C23N26C10119.7°119.8°
C23N26C18114.5°119.8°
H23C23H23A110.9°109.5°
C10N26C18125.8°120.4°
N26C10C21119.5°120.2°
N26C10O30122.1°119.9°
N26C18C14107.7°108.7°
N26C18H18110.1°109.6°
N26C18H18A110.5°109.7°
C21C10O30118.4°119.9°
C10C21C17110.4°108.6°
C10C21N29108.9°109.6°
C10C21H21109.3°109.6°
C14C18H18110.1°109.6°
C14C18H18A110.4°109.6°
C18C14C13110.1°110.9°
C18C14H14109.2°109.2°
C18C14H14A109.1°109.2°
H18C18H18A108.1°109.8°
C13C14H14109.2°109.2°
C13C14H14A109.1°109.2°
C14C13C17112.0°113.8°
C14C13H13108.7°108.6°
C14C13H13A108.1°108.6°
H14C14H14A110.0°109.1°
C17C13H13108.6°108.6°
C17C13H13A108.1°108.5°
C13C17C21111.3°110.8°
C13C17H17108.9°109.2°
C13C17H17A108.5°109.2°
H13C13H13A111.5°108.5°
C21C17H17108.9°109.1°
C21C17H17A108.5°109.2°
C17C21N29109.6°109.5°
C17C21H21108.6°109.8°
H17C17H17A110.9°109.3°
N29C21H21110.0°109.8°
C21N29C12125.1°120.0°
C21N29HN29117.4°120.0°
C12N29HN29117.5°120.0°
N29C12N28119.6°120.0°
N29C12N25119.1°120.0°
N28C12N25121.3°120.0°
C12N28C7122.2°120.0°
C12N25C1123.3°120.0°
C12N25HN25118.3°120.0°
C1N25HN25118.4°120.0°
N25C1N24177.6°180.0°
N28C7C4120.4°120.0°
N28C7C2119.5°120.0°
C4C7C2120.1°120.0°
C7C4C6118.6°119.5°
C7C4H4120.7°120.3°
C7C2C3121.2°120.5°
C7C2H2119.4°119.8°
C3C2H2119.4°119.7°
C2C3C8117.1°120.2°
C2C3H3121.5°119.9°
C6C4H4120.7°120.2°
C4C6C5131.0°134.2°
C4C6C8119.4°120.3°
C5C6C8109.6°105.5°
C6C5C9101.3°106.2°
C6C5H5129.3°126.9°
C6C8O32109.7°107.2°
C6C8C3123.6°119.6°
O32C8C3126.7°133.2°
C8O32C9104.5°110.9°
C8C3H3121.5°119.9°
O32C9C5115.0°110.1°
O32C9C22120.7°124.9°
C5C9C22124.3°124.9°
C9C5H5129.4°126.9°
C9C22H22109.5°109.5°
C9C22H22A109.4°109.5°
C9C22H22B109.5°109.5°
H22C22H22A109.5°109.5°
H22C22H22B109.5°109.4°
H22AC22H22B109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O31C11N27C23179.6°179.8°
O31C11N27C190.0°179.7°
O31C11N27C20179.8°0.1°
O31C11C23N262.6°0.0°
O31C11C23H23122.6°119.9°
O31C11C23H23A116.6°120.0°
C11N27C19C20179.7°179.7°
C11N27C20C16179.6°179.0°
C11N27C20H2060.4°59.6°
C11N27C20H20A57.8°61.5°
C11N27C19C15170.9°155.9°
C11N27C19H1950.9°85.2°
C11N27C19H19A67.1°37.1°
N27C11C23N26177.8°179.8°
N27C11C23H2357.8°60.3°
N27C11C23H23A63.0°59.8°
C23C11N27C19179.6°0.1°
C23C11N27C200.1°179.7°
C11C23N26H23120.0°120.0°
C11C23N26H23A119.3°120.0°
C11C23H23H23A119.3°120.1°
C11C23N26C1097.4°89.7°
C11C23N26C1882.5°90.0°
C19N27C20C160.6°1.3°
C19N27C20H20119.4°120.7°
C19N27C20H20A122.5°118.2°
N27C19C15C1614.2°37.3°
N27C19C15H19120.0°118.8°
N27C19C15H19A122.0°118.7°
N27C19H19H19A122.2°122.3°
N27C19C15H15134.2°81.1°
N27C19C15H15A106.7°155.1°
N27C20C16H20120.0°119.4°
N27C20C16H20A121.9°119.4°
N27C20H20H20A122.0°121.1°
N27C20C16C158.6°22.2°
N27C20C16H16111.4°140.5°
N27C20C16H16A129.3°96.4°
C20N27C19C159.3°24.5°
C20N27C19H19129.3°94.5°
C20N27C19H19A112.6°143.2°
C16C20H20H20A122.1°121.2°
C20C16C15H16120.0°118.4°
C20C16C15H16A120.7°118.5°
C20C16H16H16A120.8°123.1°
C20C16C15C1914.4°35.7°
C20C16C15H15134.4°82.5°
C20C16C15H15A106.5°153.6°
H20C20C16C15128.6°97.2°
H20C20C16H168.6°21.2°
H20C20C16H16A110.7°144.2°
H20AC20C16C15113.3°141.6°
H20AC20C16H16126.7°100.0°
H20AC20C16H16A7.5°23.0°
C15C16H16H16A120.8°123.4°
C16C15C19H15120.0°118.4°
C16C15C19H15A120.9°117.7°
C16C15C19H19134.2°81.5°
C16C15C19H19A107.8°156.0°
C16C15H15H15A120.9°123.8°
H16C16C15C19105.6°154.1°
H16C16C15H1514.4°35.9°
H16C16C15H15A133.5°88.0°
H16AC16C15C19135.1°82.7°
H16AC16C15H15104.9°159.1°
H16AC16C15H15A14.2°35.1°
C15C19H19H19A122.1°122.4°
C19C15H15H15A120.9°123.9°
H19C19C15H15105.8°160.1°
H19C19C15H15A13.3°36.2°
H19AC19C15H1512.2°37.6°
H19AC19C15H15A131.3°86.2°
N26C23H23H23A119.2°120.0°
C23N26C10C18179.9°179.8°
C23N26C10C21179.5°179.7°
C23N26C10O300.6°0.3°
C23N26C18C14112.7°108.0°
C23N26C18H187.3°11.7°
C23N26C18H18A126.6°132.2°
H23C23N26C1022.6°150.2°
H23C23N26C18157.5°30.0°
H23AC23N26C10143.4°30.3°
H23AC23N26C1836.8°150.0°
N26C10C21O30179.0°179.9°
C10N26C18C1467.4°71.8°
C10N26C18H18172.6°168.6°
C10N26C18H18A53.3°48.0°
N26C10C21C1767.2°71.4°
N26C10C21N29172.5°169.1°
N26C10C21H2152.2°48.5°
C18N26C10C210.4°0.1°
C18N26C10O30179.3°180.0°
N26C18C14H18120.0°119.7°
N26C18C14H18A120.7°119.8°
N26C18H18H18A120.7°120.5°
N26C18C14C1385.3°86.5°
N26C18C14H1434.7°33.9°
N26C18C14H14A154.9°153.2°
C10C21C17C1382.7°84.9°
C10C21C17N29120.0°119.6°
C10C21C17H21119.8°119.8°
C10C21C17H1737.3°35.4°
C10C21C17H17A158.1°154.8°
C10C21N29H21119.8°120.5°
C10C21N29C12156.0°87.6°
C10C21N29HN2924.0°92.6°
O30C10C21C17113.8°108.6°
O30C10C21N296.6°11.0°
O30C10C21H21126.8°131.6°
C14C18H18H18A120.7°120.4°
C18C14C13H14120.0°120.4°
C18C14C13H14A119.7°120.4°
C18C14H14H14A119.7°119.4°
C18C14C13C1773.4°67.0°
C18C14C13H13166.6°171.9°
C18C14C13H13A45.6°54.0°
H18C18C14C13154.7°153.9°
H18C18C14H1485.3°85.8°
H18C18C14H14A35.0°33.5°
H18AC18C14C1335.4°33.3°
H18AC18C14H14155.4°153.7°
H18AC18C14H14A84.4°87.0°
C13C14H14H14A119.8°119.2°
C14C13C17H13120.0°121.2°
C14C13C17H13A118.9°121.0°
C14C13H13H13A119.0°117.9°
C14C13C17C2170.6°66.7°
C14C13C17H1749.4°53.5°
C14C13C17H17A170.2°173.0°
H14C14C13C1746.6°53.4°
H14C14C13H1373.4°67.8°
H14C14C13H13A165.6°174.4°
H14AC14C13C17166.9°172.6°
H14AC14C13H1346.9°51.5°
H14AC14C13H13A74.2°66.4°
C17C13H13H13A119.0°117.8°
C13C17C21H17120.0°120.3°
C13C17C21H17A119.2°120.3°
C13C17H17H17A119.3°119.4°
C13C17C21N29157.3°155.5°
C13C17C21H2137.1°34.9°
H13C13C17C21169.4°172.1°
H13C13C17H1770.6°67.6°
H13C13C17H17A50.2°51.8°
H13AC13C17C2148.4°54.3°
H13AC13C17H17168.4°174.5°
H13AC13C17H17A70.9°66.0°
C21C17H17H17A119.3°119.4°
C17C21N29H21119.3°120.6°
C17C21N29C1283.2°153.5°
C17C21N29HN2996.8°26.4°
H17C17C21N2982.7°84.2°
H17C17C21H21157.1°155.2°
H17AC17C21N2938.1°35.2°
H17AC17C21H2182.1°85.4°
C21N29C12HN29180.0°179.8°
C21N29C12N28178.9°173.2°
C21N29C12N251.2°6.9°
H21C21N29C1236.2°32.9°
H21C21N29HN29143.8°147.0°
N29C12N28N25179.9°179.9°
N29C12N25C1179.3°6.2°
N29C12N25HN250.7°173.8°
N29C12N28C70.7°3.5°
HN29N29C12N281.1°6.7°
HN29N29C12N25178.8°173.2°
N28C12N25C10.6°173.8°
N28C12N25HN25179.4°6.2°
C12N28C7C4133.3°125.7°
C12N28C7C246.2°54.0°
C12N25C1HN25180.0°180.0°
C12N25C1N2479.6°133.1°
N25C12N28C7179.4°176.5°
HN25N25C1N24100.5°46.9°
N28C7C4C2179.5°179.8°
N28C7C2C3179.5°180.0°
N28C7C2H20.5°0.0°
N28C7C4C6179.6°180.0°
N28C7C4H40.4°0.0°
C4C7C2C30.0°0.2°
C4C7C2H2180.0°179.8°
C7C4C6H4180.0°180.0°
C7C4C6C5179.9°179.9°
C7C4C6C80.3°0.0°
C7C2C3H2180.0°180.0°
C2C7C4C60.1°0.2°
C2C7C4H4179.9°179.7°
C7C2C3C80.0°0.0°
C7C2C3H3180.0°180.0°
C2C3C8C60.1°0.3°
C2C3C8O32179.6°179.9°
C2C3C8H3180.0°180.0°
H2C2C3C8180.0°180.0°
H2C2C3H30.0°0.0°
C4C6C5C8179.9°179.9°
C4C6C8O32179.8°180.0°
C4C6C8C30.3°0.2°
C4C6C5C9179.8°180.0°
C4C6C5H50.2°0.1°
H4C4C6C50.1°0.0°
H4C4C6C8179.7°180.0°
C5C6C8O320.3°0.0°
C5C6C8C3179.8°179.7°
C6C5C9O320.4°0.0°
C6C5C9H5180.0°180.0°
C6C5C9C22179.8°180.0°
C6C8O32C3179.5°179.7°
C6C8C3H3179.9°179.8°
C6C8O32C90.5°0.0°
C8C6C5C90.0°0.0°
C8C6C5H5179.9°180.0°
O32C8C3H30.4°0.1°
C8O32C9C50.6°0.0°
C8O32C9C22180.0°180.0°
C3C8O32C9180.0°179.7°
O32C9C5C22179.5°180.0°
O32C9C22H22167.9°0.0°
O32C9C22H22A72.1°120.0°
O32C9C22H22B47.9°120.0°
O32C9C5H5179.6°180.0°
C5C9C22H2211.5°180.0°
C5C9C22H22A108.5°60.0°
C5C9C22H22B131.5°60.0°
C9C22H22H22A120.0°120.0°
C9C22H22H22B120.0°120.0°
C9C22H22AH22B120.0°120.0°
C22C9C5H50.1°0.1°
H22C22H22AH22B120.0°119.9°

248335

PDB entries from 2026-01-28

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