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Q2T

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C32C31sing1.53Å1.51Å
C31C30sing1.53Å1.52Å
C30C29sing1.53Å1.52Å
C29O28sing1.43Å1.43Å
O28C26sing1.36Å1.37Å
C26C25sing1.39Å1.40ÅAromatic
C26C27doub1.39Å1.40ÅAromatic
C25N24doub1.32Å1.35ÅAromatic
N24C23sing1.32Å1.35ÅAromatic
C23C22doub1.40Å1.41ÅAromatic
C27C22sing1.40Å1.38ÅAromatic
C22C9sing1.48Å1.48Å
C9N8doub1.32Å1.34ÅAromatic
C9N2sing1.36Å1.35ÅAromatic
N8N7sing1.29Å1.39ÅAromatic
N7C1doub1.32Å1.35ÅAromatic
C1C6sing1.41Å1.47ÅAromatic
C1N2sing1.38Å1.35ÅAromatic
C6C14sing1.51Å1.51Å
C6N5doub1.31Å1.34ÅAromatic
N5C4sing1.36Å1.36ÅAromatic
N2C3sing1.38Å1.42ÅAromatic
C3C13doub1.39Å1.40ÅAromatic
C3C4sing1.41Å1.41ÅAromatic
C13C12sing1.38Å1.40ÅAromatic
C12C11doub1.39Å1.39ÅAromatic
C12C15sing1.51Å1.51Å
C11C10sing1.38Å1.39ÅAromatic
C10C4doub1.40Å1.39ÅAromatic
C15N16sing1.47Å1.46Å
N16C21sing1.47Å1.47Å
N16C17sing1.47Å1.48Å
C21C20sing1.53Å1.53Å
C20O19sing1.43Å1.42Å
O19C18sing1.43Å1.43Å
C18C17sing1.53Å1.52Å
C32H321sing1.09Å1.10Å
C32H322sing1.09Å1.10Å
C32H323sing1.09Å1.10Å
C31H311sing1.09Å1.10Å
C31H312sing1.09Å1.10Å
C30H301sing1.09Å1.10Å
C30H302sing1.09Å1.10Å
C29H291sing1.09Å1.10Å
C29H292sing1.09Å1.10Å
C25H25sing1.08Å1.08Å
C27H27sing1.08Å1.08Å
C23H23sing1.08Å1.08Å
C14H141sing1.09Å1.10Å
C14H142sing1.09Å1.10Å
C14H143sing1.09Å1.10Å
C13H13sing1.08Å1.08Å
C11H11sing1.08Å1.08Å
C15H151sing1.09Å1.10Å
C15H152sing1.09Å1.10Å
C10H10sing1.08Å1.08Å
C21H211sing1.09Å1.10Å
C21H212sing1.09Å1.10Å
C17H171sing1.09Å1.10Å
C17H172sing1.09Å1.10Å
C20H201sing1.09Å1.10Å
C20H202sing1.09Å1.10Å
C18H181sing1.09Å1.10Å
C18H182sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C32C31C30111.8°109.4°
C31C32H321109.5°109.5°
C31C32H322109.5°109.5°
C31C32H323109.5°109.5°
C32C31H311108.9°109.5°
C32C31H312108.9°109.5°
C31C30C29110.0°109.5°
C30C31H311108.9°109.5°
C30C31H312108.9°109.5°
C31C30H301109.4°109.4°
C31C30H302109.3°109.5°
C30C29O28109.9°109.5°
C29C30H301109.3°109.5°
C29C30H302109.3°109.5°
C30C29H291109.4°109.4°
C30C29H292109.3°109.5°
C29O28C26123.6°117.0°
O28C29H291109.4°109.5°
O28C29H292109.4°109.5°
O28C26C25117.7°120.4°
O28C26C27122.0°120.4°
C25C26C27120.3°119.2°
C26C25N24120.9°121.0°
C26C25H25119.6°119.5°
C26C27C22118.1°118.3°
C26C27H27120.9°120.9°
C25N24C23119.4°122.0°
N24C25H25119.6°119.5°
N24C23C22121.9°120.7°
N24C23H23119.1°119.7°
C23C22C27119.0°118.9°
C23C22C9113.8°120.6°
C22C23H23119.1°119.6°
C27C22C9126.1°120.6°
C22C27H27120.9°120.8°
C22C9N8121.4°126.4°
C22C9N2127.4°126.4°
N8C9N2110.5°107.2°
C9N8N7106.4°110.1°
C9N2C1105.8°106.1°
C9N2C3134.2°134.7°
N8N7C1106.7°109.8°
N7C1C6129.0°133.7°
N7C1N2110.5°106.9°
C6C1N2120.5°119.5°
C1C6C14119.0°119.6°
C1C6N5118.5°120.8°
C1N2C3119.9°119.2°
C14C6N5122.6°119.6°
C6C14H141109.5°109.5°
C6C14H142109.5°109.5°
C6C14H143109.4°109.5°
C6N5C4121.2°121.4°
N5C4C3121.9°120.2°
N5C4C10117.2°120.5°
N2C3C13124.5°121.1°
N2C3C4118.0°119.0°
C13C3C4117.6°119.8°
C3C13C12121.3°120.0°
C3C13H13119.4°120.0°
C3C4C10120.9°119.3°
C13C12C11120.3°120.5°
C13C12C15119.6°119.8°
C12C13H13119.4°120.0°
C11C12C15120.0°119.8°
C12C11C10119.1°120.5°
C12C11H11120.4°119.8°
C12C15N16119.3°109.5°
C12C15H151107.0°109.4°
C12C15H152106.9°109.4°
C11C10C4120.8°119.8°
C10C11H11120.4°119.7°
C11C10H10119.6°120.1°
C4C10H10119.6°120.0°
C15N16C21108.8°111.0°
C15N16C17105.4°111.0°
N16C15H151106.9°109.5°
N16C15H152106.9°109.5°
C21N16C17111.0°110.7°
N16C21C20111.4°109.3°
N16C21H211109.0°109.5°
N16C21H212109.0°109.5°
N16C17C18110.1°109.2°
N16C17H171109.3°109.5°
N16C17H172109.3°109.5°
C21C20O19110.0°109.3°
C20C21H211109.0°109.5°
C20C21H212109.0°109.5°
C21C20H201109.3°109.5°
C21C20H202109.3°109.5°
C20O19C18110.2°113.7°
O19C20H201109.3°109.5°
O19C20H202109.3°109.5°
O19C18C17108.4°109.3°
O19C18H181109.7°109.5°
O19C18H182109.7°109.5°
C18C17H171109.3°109.5°
C18C17H172109.3°109.5°
C17C18H181109.7°109.5°
C17C18H182109.7°109.5°
H321C32H322109.5°109.5°
H321C32H323109.5°109.4°
H322C32H323109.4°109.5°
H311C31H312109.5°109.5°
H301C30H302109.5°109.5°
H291C29H292109.4°109.5°
H141C14H142109.4°109.4°
H141C14H143109.5°109.5°
H142C14H143109.5°109.4°
H151C15H152109.5°109.5°
H211C21H212109.5°109.5°
H171C17H172109.5°109.5°
H201C20H202109.5°109.5°
H181C18H182109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C32C31C30H311120.4°120.0°
C32C31C30H312120.4°120.0°
C32C31C30C29176.4°180.0°
C31C32H321H322120.0°120.0°
C31C32H321H323120.0°120.0°
C31C32H322H323120.0°120.0°
C32C31H311H312118.9°120.0°
C32C31C30H30163.5°60.0°
C32C31C30H30256.4°60.0°
C31C30C29H301120.1°119.9°
C31C30C29H302120.1°120.0°
C31C30C29O28173.9°180.0°
C30C31C32H321180.0°180.0°
C30C31C32H32260.0°60.0°
C30C31C32H32360.0°60.0°
C30C31H311H312118.9°120.0°
C31C30H301H302119.8°120.0°
C31C30C29H29166.0°60.0°
C31C30C29H29253.8°60.0°
C30C29O28H291120.1°120.0°
C30C29O28H292120.1°120.0°
C30C29O28C2679.1°180.0°
C29C30C31H31156.1°60.0°
C29C30C31H31263.2°60.0°
C29C30H301H302119.7°120.0°
C30C29H291H292119.8°120.0°
C29O28C26C25175.5°0.0°
C29O28C26C274.5°179.7°
O28C29C30H30153.8°60.1°
O28C29C30H30266.0°60.0°
O28C29H291H292119.8°120.0°
O28C26C25C27180.0°179.7°
O28C26C25N24179.8°180.0°
O28C26C27C22176.9°179.8°
C26O28C29H29141.0°60.0°
C26O28C29H292160.8°60.0°
O28C26C25H250.2°0.1°
O28C26C27H273.1°0.0°
C26C25N24H25180.0°179.9°
C26C25N24C230.5°0.0°
C25C26C27C223.2°0.5°
C25C26C27H27176.9°179.7°
C27C26C25N240.2°0.3°
C26C27C22C237.0°0.5°
C26C27C22H27180.0°179.7°
C26C27C22C9173.9°179.8°
C27C26C25H25179.8°179.8°
C25N24C23C224.5°0.0°
C25N24C23H23175.5°180.0°
N24C23C22H23180.0°179.9°
N24C23C22C277.9°0.2°
N24C23C22C9176.4°179.9°
C23N24C25H25179.5°179.9°
C23C22C27C9166.9°179.7°
C23C22C9N8107.2°123.8°
C23C22C9N261.5°55.9°
C23C22C27H27173.1°179.7°
C27C22C9N860.3°56.5°
C27C22C9N2131.0°123.8°
C27C22C23H23172.1°179.7°
C22C9N8N2170.4°179.7°
C22C9N8N7173.7°180.0°
C22C9N2C1173.1°179.9°
C22C9N2C310.1°0.0°
C9C22C27H276.2°0.0°
C9C22C23H233.6°0.0°
C9N8N7C11.9°0.0°
N8C9N2C13.4°0.4°
N8C9N2C3179.8°179.7°
N2C9N8N73.3°0.2°
C9N2C1N72.2°0.4°
C9N2C1C6178.9°179.8°
C9N2C1C3177.3°179.9°
C9N2C3C133.0°0.0°
C9N2C3C4177.2°179.2°
N8N7C1C6179.1°180.0°
N8N7C1N20.2°0.2°
N7C1C6N2178.7°179.7°
N7C1C6C140.9°0.1°
N7C1C6N5179.5°180.0°
N7C1N2C3179.5°179.7°
C1C6C14N5178.6°180.0°
C1C6N5C41.2°0.0°
C6C1N2C31.5°0.1°
C1C6C14H141178.6°90.0°
C1C6C14H14258.6°150.0°
C1C6C14H14361.4°30.0°
N2C1C6C14179.6°179.8°
N2C1C6N51.7°0.3°
C1N2C3C13179.4°179.9°
C1N2C3C40.8°0.7°
C14C6N5C4179.8°180.0°
C6C14H141H142120.0°120.0°
C6C14H141H143120.0°120.1°
C6C14H142H143120.0°120.1°
C6N5C4C30.5°0.6°
C6N5C4C10179.4°178.9°
N5C6C14H1410.0°90.0°
N5C6C14H142120.0°30.0°
N5C6C14H143120.0°150.0°
N5C4C3N20.2°0.9°
N5C4C3C13180.0°179.9°
N5C4C3C10179.8°178.3°
N5C4C10C11179.6°179.8°
N5C4C10H100.5°0.9°
N2C3C13C4179.8°179.2°
N2C3C13C12179.4°180.0°
N2C3C4C10179.6°179.2°
N2C3C13H130.6°0.1°
C3C13C12H13180.0°179.9°
C3C13C12C111.0°0.0°
C3C13C12C15177.7°180.0°
C13C3C4C100.2°1.5°
C4C3C13C120.4°0.8°
C3C4C10C110.6°1.5°
C4C3C13H13179.6°179.3°
C3C4C10H10179.4°179.2°
C13C12C11C15176.7°180.0°
C13C12C11C101.3°0.0°
C13C12C15N16111.6°90.0°
C13C12C11H11178.7°180.0°
C13C12C15H1519.8°150.0°
C13C12C15H152127.0°30.0°
C12C11C10H11180.0°180.0°
C12C11C10C41.2°0.7°
C11C12C15N1671.7°90.0°
C11C12C13H13179.0°179.9°
C11C12C15H151166.9°30.0°
C11C12C15H15249.7°149.9°
C12C11C10H10178.8°180.0°
C15C12C11C10178.0°180.0°
C12C15N16H151121.4°119.9°
C12C15N16H152121.4°120.0°
C12C15N16C2179.6°170.0°
C12C15N16C17161.3°66.4°
C15C12C13H132.3°0.0°
C15C12C11H112.0°0.0°
C12C15H151H152115.5°119.9°
C11C10C4H10180.0°179.3°
C4C10C11H11178.9°179.3°
C15N16C21C17115.6°123.7°
C15N16C21C20166.4°177.6°
C15N16C17C18171.6°177.6°
N16C15H151H152115.5°120.1°
C15N16C21H21173.3°57.7°
C15N16C21H21246.1°62.4°
C15N16C17H17151.5°62.4°
C15N16C17H17268.3°57.7°
N16C21C20H211120.3°120.0°
N16C21C20H212120.3°120.0°
N16C21C20O1954.5°56.9°
C21N16C17C1854.0°58.6°
C21N16C15H15141.8°50.1°
C21N16C15H152159.0°70.0°
N16C21H211H212119.1°120.1°
C21N16C17H17166.1°61.3°
C21N16C17H172174.1°178.6°
N16C21C20H20165.6°63.1°
N16C21C20H202174.6°176.8°
C17N16C21C2050.9°58.6°
N16C17C18O1960.5°56.9°
N16C17C18H171120.1°119.9°
N16C17C18H172120.1°120.0°
C17N16C15H15177.3°173.7°
C17N16C15H15239.9°53.6°
C17N16C21H211171.1°178.6°
C17N16C21H21269.4°61.3°
N16C17H171H172119.7°120.1°
N16C17C18H18159.3°63.1°
N16C17C18H182179.6°176.8°
C21C20O19H201120.1°119.9°
C21C20O19H202120.1°120.0°
C21C20O19C1862.0°58.6°
C20C21H211H212119.1°120.1°
C21C20H201H202119.7°120.1°
C20O19C18C1765.1°58.7°
O19C20C21H211174.8°176.8°
O19C20C21H21265.8°63.1°
O19C20H201H202119.7°120.1°
C20O19C18H18154.8°61.3°
C20O19C18H182175.1°178.6°
O19C18C17H181119.8°120.0°
O19C18C17H182119.8°119.9°
O19C18C17H17159.6°63.1°
O19C18C17H172179.4°176.8°
C18O19C20H20158.0°61.3°
C18O19C20H202177.9°178.6°
O19C18H181H182120.5°120.1°
C18C17H171H172119.7°120.1°
C17C18H181H182120.5°120.1°
H321C32H322H323120.0°119.9°
H321C32C31H31159.6°60.0°
H321C32C31H31259.7°60.0°
H322C32C31H31160.4°60.0°
H322C32C31H312179.7°180.0°
H323C32C31H311179.7°180.0°
H323C32C31H31260.4°59.9°
H311C31C30H301176.2°180.0°
H311C31C30H30264.0°60.0°
H312C31C30H30156.9°59.9°
H312C31C30H302176.7°180.0°
H301C30C29H291173.9°179.9°
H301C30C29H29266.3°59.9°
H302C30C29H29154.1°60.0°
H302C30C29H292173.9°180.0°
H141C14H142H143120.0°119.9°
H11C11C10H101.2°0.0°
H211C21C20H20154.7°56.9°
H211C21C20H20265.1°63.2°
H212C21C20H201174.1°177.0°
H212C21C20H20254.3°56.8°
H171C17C18H181179.4°177.0°
H171C17C18H18260.2°56.9°
H172C17C18H18160.7°56.9°
H172C17C18H18259.6°63.2°

221716

PDB entries from 2024-06-26

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