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33U

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C37C7doub1.38Å1.40ÅAromatic
C37C26sing1.38Å1.40ÅAromatic
C37H37sing1.08Å1.08Å
C26C25doub1.38Å1.39ÅAromatic
C26H26sing1.08Å1.08Å
C25C34sing1.38Å1.39ÅAromatic
C25H25sing1.08Å1.08Å
C23C34doub1.38Å1.40ÅAromatic
C34H34sing1.08Å1.08Å
C7C23sing1.38Å1.40ÅAromatic
C23H23sing1.08Å1.08Å
C8C7sing1.51Å1.55Å
C9C8sing1.53Å1.55Å
C8C1sing1.51Å1.55Å
C8H8sing1.09Å1.10Å
C10C9sing1.51Å1.52Å
N2C9sing1.47Å1.50Å
C9H9sing1.09Å1.10Å
N1C10sing1.35Å1.36Å
C10O32doub1.21Å1.23Å
C11N1sing1.48Å1.47Å
C14N1sing1.47Å1.46Å
C13C14sing1.54Å1.56Å
C15C14sing1.51Å1.52Å
C14H14sing1.09Å1.10Å
O22C15doub1.21Å1.22Å
C15N23sing1.35Å1.35Å
C16N23sing1.47Å1.49Å
N23HN23sing0.97Å1.00Å
C16C17sing1.51Å1.53Å
C16H16sing1.09Å1.10Å
C16H16Asing1.09Å1.10Å
C17C18doub1.38Å1.40ÅAromatic
C17C22sing1.38Å1.39ÅAromatic
C22C21doub1.38Å1.39ÅAromatic
C22H22sing1.08Å1.08Å
C21C24sing1.39Å1.40ÅAromatic
C21H21sing1.08Å1.08Å
C19C24doub1.39Å1.39ÅAromatic
C24C27sing1.48Å1.52Å
C27N35doub1.30Å1.35Å
C27N34sing1.38Å1.27Å
N35HN35sing0.97Å1.00Å
N34HN34sing0.97Å1.00Å
N34HN3Asing0.97Å1.00Å
C18C19sing1.38Å1.41ÅAromatic
C19H19sing1.08Å1.08Å
C18H18sing1.08Å1.08Å
C13C12sing1.55Å1.55Å
C13H13sing1.09Å1.10Å
C13H13Asing1.09Å1.10Å
C12C11sing1.55Å1.56Å
C12H12sing1.09Å1.10Å
C12H12Asing1.09Å1.10Å
C11H11sing1.09Å1.10Å
C11H11Asing1.09Å1.10Å
N2HN2sing1.01Å1.00Å
N2HN2Asing1.01Å1.00Å
C6C1doub1.38Å1.40ÅAromatic
C1C2sing1.38Å1.39ÅAromatic
C6C5sing1.38Å1.41ÅAromatic
C6H6sing1.08Å1.08Å
C5C4doub1.38Å1.39ÅAromatic
C5H5sing1.08Å1.08Å
C4C3sing1.38Å1.40ÅAromatic
C4H4sing1.08Å1.08Å
C2C3doub1.38Å1.40ÅAromatic
C3H3sing1.08Å1.08Å
C2H2sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C7C37C26119.8°120.0°
C7C37H37120.1°120.1°
C37C7C23120.0°120.0°
C37C7C8116.7°120.0°
C26C37H37120.1°120.0°
C37C26C25119.6°120.0°
C37C26H26120.2°120.0°
C25C26H26120.2°120.0°
C26C25C34121.0°120.0°
C26C25H25119.5°120.0°
C34C25H25119.5°120.0°
C25C34C23119.3°120.0°
C25C34H34120.3°120.0°
C23C34H34120.3°120.0°
C34C23C7120.3°120.0°
C34C23H23119.9°119.9°
C7C23H23119.9°120.0°
C23C7C8123.3°120.0°
C7C8C9116.3°109.5°
C7C8C1108.5°109.5°
C7C8H8105.8°109.5°
C9C8C1110.7°109.5°
C9C8H8103.4°109.5°
C8C9C10108.2°109.4°
C8C9N2112.9°109.5°
C8C9H9108.9°109.5°
C1C8H8111.9°109.5°
C8C1C6121.9°120.0°
C8C1C2119.4°120.0°
C10C9N2112.1°109.5°
C10C9H9109.8°109.5°
C9C10N1124.5°120.0°
C9C10O32115.4°120.0°
N2C9H9104.8°109.5°
C9N2HN2109.5°111.0°
C9N2HN2A109.5°111.0°
N1C10O32120.2°120.0°
C10N1C11123.9°125.6°
C10N1C14119.4°125.7°
C11N1C14114.9°108.7°
N1C11C1296.5°104.7°
N1C11H11114.1°110.7°
N1C11H11A114.1°110.2°
N1C14C13102.0°107.3°
N1C14C15107.2°109.8°
N1C14H14114.8°109.9°
C13C14C15107.3°110.0°
C13C14H14114.7°109.9°
C14C13C12102.3°103.0°
C14C13H13112.0°110.7°
C14C13H13A112.0°110.7°
C15C14H14110.2°109.9°
C14C15O22117.4°120.0°
C14C15N23116.4°120.0°
O22C15N23126.2°120.0°
C15N23C16115.1°120.1°
C15N23HN23122.4°120.0°
C16N23HN23122.5°119.9°
N23C16C17106.5°109.5°
N23C16H16110.5°109.5°
N23C16H16A110.5°109.4°
C17C16H16110.5°109.5°
C17C16H16A110.4°109.5°
C16C17C18123.1°119.8°
C16C17C22118.8°119.9°
H16C16H16A108.5°109.5°
C18C17C22118.1°120.3°
C17C18C19119.8°120.1°
C17C18H18120.1°119.9°
C17C22C21122.7°120.2°
C17C22H22118.7°119.9°
C21C22H22118.7°119.9°
C22C21C24119.4°119.9°
C22C21H21120.3°120.1°
C24C21H21120.3°120.1°
C21C24C19118.6°119.7°
C21C24C27118.8°120.1°
C19C24C27122.6°120.1°
C24C19C18121.4°119.8°
C24C19H19119.3°120.1°
C24C27N35120.5°120.0°
C24C27N34119.9°120.0°
N35C27N34119.5°120.0°
C27N35HN35112.0°120.0°
C27N34HN34120.0°120.0°
C27N34HN3A120.0°120.0°
HN34N34HN3A120.0°120.0°
C18C19H19119.3°120.1°
C19C18H18120.1°119.9°
C12C13H13111.9°110.7°
C12C13H13A112.0°110.8°
C13C12C11102.3°101.5°
C13C12H12111.9°111.0°
C13C12H12A111.9°111.0°
H13C13H13A106.9°110.8°
C11C12H12111.9°111.2°
C11C12H12A111.9°110.9°
C12C11H11114.1°110.4°
C12C11H11A114.0°110.4°
H12C12H12A106.9°110.9°
H11C11H11A104.5°110.4°
HN2N2HN2A109.4°111.0°
C6C1C2118.7°120.0°
C1C6C5119.3°120.0°
C1C6H6120.3°120.0°
C1C2C3122.1°120.0°
C1C2H2119.0°120.0°
C5C6H6120.4°120.0°
C6C5C4121.7°120.0°
C6C5H5119.2°120.0°
C4C5H5119.2°120.0°
C5C4C3119.2°120.0°
C5C4H4120.4°120.0°
C3C4H4120.4°120.0°
C4C3C2119.1°120.0°
C4C3H3120.4°120.0°
C2C3H3120.4°119.9°
C3C2H2118.9°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C7C37C26H37180.0°179.7°
C7C37C26C250.0°0.1°
C7C37C26H26180.0°179.9°
C37C7C23C340.1°0.1°
C37C7C23C8179.9°180.0°
C37C7C23H23179.9°180.0°
C37C7C8C935.7°124.1°
C37C7C8C189.9°115.9°
C37C7C8H8149.8°4.0°
C37C26C25H26180.0°179.8°
C37C26C25C340.0°0.1°
C37C26C25H25180.0°179.9°
C26C37C7C230.0°0.0°
C26C37C7C8180.0°180.0°
H37C37C26C25180.0°179.8°
H37C37C26H260.0°0.4°
H37C37C7C23180.0°179.7°
H37C37C7C80.0°0.3°
C26C25C34H25180.0°180.0°
C26C25C34C230.0°0.0°
C26C25C34H34180.0°179.9°
H26C26C25C34180.0°179.9°
H26C26C25H250.0°0.1°
C25C34C23H34180.0°180.0°
C25C34C23C70.1°0.0°
C25C34C23H23179.9°180.0°
H25C25C34C23180.0°180.0°
H25C25C34H340.0°0.0°
C34C23C7H23180.0°179.9°
C34C23C7C8180.0°179.9°
H34C34C23C7180.0°180.0°
H34C34C23H230.1°0.1°
C23C7C8C9144.4°55.9°
C23C7C8C190.0°64.1°
C23C7C8H830.3°176.0°
H23C23C7C80.0°0.0°
C7C8C9C1124.5°120.0°
C7C8C9H8115.4°120.0°
C7C8C1H8116.4°120.0°
C7C8C9C10176.0°174.8°
C7C8C9N251.3°65.2°
C7C8C9H964.7°54.8°
C7C8C1C674.4°12.4°
C7C8C1C2105.7°167.4°
C9C8C1H8114.8°120.0°
C8C9C10N2125.1°120.0°
C8C9C10H9118.8°120.0°
C8C9N2H9118.4°120.0°
C8C9C10N1108.2°80.1°
C8C9C10O3271.9°100.0°
C8C9N2HN2180.0°80.1°
C8C9N2HN2A60.0°43.9°
C9C8C1C654.4°107.6°
C9C8C1C2125.5°72.6°
C1C8C9C1059.6°65.2°
C1C8C9N2175.8°54.8°
C1C8C9H959.8°174.8°
C8C1C6C2180.0°179.7°
C8C1C6C5180.0°180.0°
C8C1C6H60.0°0.0°
C8C1C2C3180.0°179.8°
C8C1C2H20.0°0.0°
H8C8C9C1060.5°54.8°
H8C8C9N264.1°174.8°
H8C8C9H9179.9°65.2°
H8C8C1C6169.2°132.3°
H8C8C1C210.7°47.4°
C10C9N2H9119.1°120.0°
C9C10N1O32180.0°179.9°
C9C10N1C1116.4°0.4°
C9C10N1C14179.7°180.0°
C10C9N2HN257.5°159.9°
C10C9N2HN2A177.5°76.1°
N2C9C10N1126.7°160.0°
N2C9C10O3253.3°20.0°
C9N2HN2HN2A120.0°124.0°
H9C9C10N110.6°39.9°
H9C9C10O32169.3°140.0°
H9C9N2HN261.6°39.9°
H9C9N2HN2A58.4°163.9°
C10N1C11C14164.6°179.7°
C10N1C14C13173.7°179.0°
C10N1C14C1561.1°59.4°
C10N1C14H1461.6°61.5°
C10N1C11C12161.7°155.9°
C10N1C11H1141.7°85.2°
C10N1C11H11A78.3°37.2°
O32C10N1C11163.5°179.7°
O32C10N1C140.4°0.1°
C11N1C14C138.4°1.3°
C11N1C14C15104.2°120.9°
C11N1C14H14133.1°118.1°
N1C11C12C1344.8°37.3°
N1C11C12H11120.0°119.1°
N1C11C12H11A120.0°118.5°
N1C11C12H12164.8°80.8°
N1C11C12H12A75.2°155.3°
N1C11H11H11A125.2°122.3°
N1C14C13C15112.5°119.5°
N1C14C13H14124.8°119.4°
N1C14C15H14125.6°121.0°
N1C14C15O2239.0°0.0°
N1C14C15N23142.9°180.0°
N1C14C13C1221.5°22.2°
N1C14C13H1398.5°140.5°
N1C14C13H13A141.5°96.2°
C14N1C11C1233.7°24.5°
C14N1C11H11153.7°94.5°
C14N1C11H11A86.3°143.1°
C13C14C15H14125.5°121.1°
C13C14C15O2269.9°117.9°
C13C14C15N23108.1°62.1°
C14C13C12H13120.0°118.3°
C14C13C12H13A120.0°118.4°
C14C13H13H13A122.9°123.2°
C14C13C12C1142.3°35.7°
C14C13C12H12162.3°82.5°
C14C13C12H12A77.6°153.6°
C14C15O22N23177.9°180.0°
C14C15N23C16176.4°180.0°
C14C15N23HN233.6°0.0°
C15C14C13C12134.0°97.2°
C15C14C13H1314.0°21.0°
C15C14C13H13A106.0°144.3°
H14C14C15O22164.6°121.0°
H14C14C15N2317.4°59.0°
H14C14C13C12103.3°141.6°
H14C14C13H13136.7°100.1°
H14C14C13H13A16.7°23.2°
O22C15N23C161.5°0.0°
O22C15N23HN23178.5°180.0°
C15N23C16HN23180.0°180.0°
C15N23C16C17114.7°180.0°
C15N23C16H16125.3°60.0°
C15N23C16H16A5.3°60.0°
N23C16C17H16120.0°120.0°
N23C16C17H16A120.0°119.9°
N23C16H16H16A121.2°119.9°
N23C16C17C1899.1°90.1°
N23C16C17C2280.9°89.7°
HN23N23C16C1765.3°0.0°
HN23N23C16H1654.7°120.0°
HN23N23C16H16A174.7°120.0°
C17C16H16H16A121.2°120.1°
C16C17C18C22180.0°179.8°
C16C17C22C21180.0°180.0°
C16C17C22H220.0°0.1°
C16C17C18C19180.0°179.7°
C16C17C18H180.1°0.1°
H16C16C17C1820.9°29.9°
H16C16C17C22159.1°150.3°
H16AC16C17C18140.9°150.0°
H16AC16C17C2239.1°30.2°
C18C17C22C210.0°0.2°
C18C17C22H22180.0°179.8°
C17C18C19C240.1°0.5°
C17C18C19H18180.0°179.9°
C17C18C19H19179.9°179.7°
C17C22C21H22180.0°180.0°
C17C22C21C240.0°0.0°
C17C22C21H21180.0°180.0°
C22C17C18C190.0°0.5°
C22C17C18H18180.0°179.7°
C22C21C24H21180.0°180.0°
C22C21C24C190.1°0.0°
C22C21C24C27179.9°180.0°
H22C22C21C24180.0°180.0°
H22C22C21H210.0°0.0°
C21C24C19C27179.8°180.0°
C21C24C27N3521.1°0.0°
C21C24C27N34158.9°180.0°
C21C24C19C180.1°0.2°
C21C24C19H19179.9°180.0°
H21C21C24C19179.9°180.0°
H21C21C24C270.1°0.0°
C19C24C27N35159.0°180.0°
C19C24C27N3420.9°0.0°
C24C19C18H19180.0°179.8°
C24C19C18H18179.9°179.7°
C24C27N35N34180.0°180.0°
C24C27N35HN35180.0°180.0°
C24C27N34HN34180.0°0.0°
C24C27N34HN3A0.0°180.0°
C27C24C19C18179.9°179.7°
C27C24C19H190.1°0.1°
N35C27N34HN340.0°180.0°
N35C27N34HN3A180.0°0.0°
N34C27N35HN350.0°0.0°
C27N34HN34HN3A180.0°180.0°
H19C19C18H180.1°0.1°
C12C13H13H13A122.9°123.3°
C13C12C11H12120.0°118.2°
C13C12C11H12A120.0°118.0°
C13C12H12H12A122.9°124.0°
C13C12C11H11164.8°81.8°
C13C12C11H11A75.2°155.9°
H13C13C12C1177.7°154.0°
H13C13C12H1242.3°35.8°
H13C13C12H12A162.4°88.1°
H13AC13C12C11162.3°82.7°
H13AC13C12H1277.7°159.0°
H13AC13C12H12A42.4°35.2°
C11C12H12H12A122.8°123.8°
C12C11H11H11A125.2°122.3°
H12C12C11H1175.2°160.0°
H12C12C11H11A44.8°37.7°
H12AC12C11H1144.8°36.2°
H12AC12C11H11A164.8°86.2°
C1C6C5H6180.0°180.0°
C1C6C5C40.1°0.0°
C1C6C5H5179.9°180.0°
C6C1C2C30.1°0.5°
C6C1C2H2179.9°179.7°
C2C1C6C50.0°0.3°
C2C1C6H6180.0°179.7°
C1C2C3C40.0°0.4°
C1C2C3H2180.0°179.9°
C1C2C3H3180.0°179.7°
C6C5C4H5180.0°180.0°
C6C5C4C30.1°0.1°
C6C5C4H4179.9°180.0°
H6C6C5C4179.9°180.0°
H6C6C5H50.1°0.0°
C5C4C3H4180.0°180.0°
C5C4C3C20.1°0.1°
C5C4C3H3179.9°180.0°
H5C5C4C3179.9°180.0°
H5C5C4H40.1°0.0°
C4C3C2H3180.0°179.9°
C4C3C2H2180.0°179.8°
H4C4C3C2180.0°179.8°
H4C4C3H30.1°0.0°
H3C3C2H20.0°0.1°

223532

PDB entries from 2024-08-07

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