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FR9

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1N2sing1.35Å1.47ÅAromatic
C1C5doub1.36Å1.36ÅAromatic
C1H1sing1.08Å1.10Å
N2C3sing1.36Å1.33ÅAromatic
N2C13sing1.46Å1.47Å
C3N4doub1.30Å1.31ÅAromatic
C3H3sing1.08Å1.10Å
N4C5sing1.36Å1.46ÅAromatic
C5C8sing1.47Å1.45Å
C8O9doub1.22Å1.11Å
C8N10sing1.35Å1.24Å
N10H101sing0.97Å1.02Å
N10H102sing0.97Å1.02Å
C13C14sing1.53Å1.56Å
C13C18sing1.53Å1.52Å
C13H13sing1.09Å1.12Å
C14O15sing1.43Å1.51Å
C14H141sing1.09Å1.12Å
C14H142sing1.09Å1.12Å
O15H15sing0.97Å0.95Å
C18C19sing1.53Å1.53Å
C18H181sing1.09Å1.11Å
C18H182sing1.09Å1.12Å
C19N22sing1.46Å1.45Å
C19H191sing1.09Å1.11Å
C19H192sing1.09Å1.11Å
N22C27sing1.37Å1.38ÅAromatic
N22C30sing1.38Å1.31ÅAromatic
C27C28doub1.34Å1.36ÅAromatic
C27H27sing1.08Å1.10Å
C28C29sing1.46Å1.42ÅAromatic
C28H28sing1.08Å1.10Å
C29C30doub1.41Å1.41ÅAromatic
C29C31sing1.40Å1.37ÅAromatic
C30C34sing1.39Å1.33ÅAromatic
C31C32doub1.37Å1.40ÅAromatic
C31H31sing1.08Å1.10Å
C32C33sing1.39Å1.40ÅAromatic
C32H32sing1.08Å1.10Å
C33C34doub1.38Å1.37ÅAromatic
C33N1sing1.40Å1.31Å
C34H34sing1.08Å1.10Å
N1C2sing1.35Å1.36Å
N1HN1sing0.97Å1.02Å
C2O1doub1.22Å1.21Å
C2N3sing1.35Å1.29Å
N3C6sing1.46Å1.44Å
N3HN3sing0.97Å1.02Å
C6C11sing1.51Å1.51Å
C6H61sing1.09Å1.12Å
C6H62sing1.09Å1.12Å
C7C11doub1.38Å1.39ÅAromatic
C7C15sing1.38Å1.39ÅAromatic
C7H7sing1.08Å1.10Å
C11C9sing1.38Å1.38ÅAromatic
C9C12doub1.38Å1.39ÅAromatic
C9H9sing1.08Å1.10Å
C12C10sing1.38Å1.40ÅAromatic
C12H12sing1.08Å1.10Å
C10C15doub1.38Å1.36ÅAromatic
C10H10sing1.08Å1.10Å
C15H2sing1.08Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N2C1C5110.3°106.9°
N2C1H1128.1°126.5°
C1N2C3102.1°107.7°
C1N2C13130.1°126.2°
C5C1H1121.6°126.6°
C1C5N4104.4°107.5°
C1C5C8131.4°126.2°
C3N2C13126.5°126.1°
N2C3N4116.3°109.0°
N2C3H3122.5°125.5°
N2C13C14115.0°109.5°
N2C13C18110.8°109.5°
N2C13H13104.3°109.4°
N4C3H3121.2°125.5°
C3N4C5106.8°108.9°
N4C5C8124.1°126.3°
C5C8O9113.9°120.1°
C5C8N10119.6°120.0°
O9C8N10126.1°119.9°
C8N10H101119.6°120.0°
C8N10H102126.1°120.0°
H101N10H102113.9°120.0°
C14C13C18108.6°109.5°
C14C13H13106.7°109.5°
C13C14O15124.6°109.4°
C13C14H141106.9°109.5°
C13C14H142106.9°109.5°
C18C13H13111.3°109.5°
C13C18C19111.6°109.5°
C13C18H181111.4°109.5°
C13C18H182111.4°109.5°
O15C14H141106.8°109.4°
O15C14H142106.9°109.4°
C14O15H15124.6°106.7°
H141C14H142102.7°109.5°
C19C18H181111.5°109.5°
C19C18H182111.4°109.5°
C18C19N22109.1°109.5°
C18C19H191112.3°109.5°
C18C19H192112.3°109.5°
H181C18H18298.9°109.5°
N22C19H191112.3°109.5°
N22C19H192112.3°109.5°
C19N22C27124.4°125.1°
C19N22C30125.1°125.1°
H191C19H19298.1°109.5°
C27N22C30110.4°109.8°
N22C27C28109.4°109.9°
N22C27H27125.7°125.0°
N22C30C29107.3°107.1°
N22C30C34131.9°133.4°
C28C27H27124.9°125.1°
C27C28C29105.3°107.0°
C27C28H28125.8°126.5°
C29C28H28128.9°126.5°
C28C29C30107.6°106.1°
C28C29C31133.0°133.9°
C30C29C31119.4°120.0°
C29C30C34120.8°119.5°
C29C31C32119.7°119.9°
C29C31H31119.2°120.1°
C30C34C33120.8°119.7°
C30C34H34118.1°120.2°
C32C31H31121.1°120.1°
C31C32C33119.1°120.4°
C31C32H32120.4°119.8°
C33C32H32120.5°119.8°
C32C33C34120.2°120.5°
C32C33N1125.4°119.7°
C34C33N1113.9°119.7°
C33C34H34121.1°120.2°
C33N1C2126.7°120.1°
C33N1HN1106.2°120.0°
C2N1HN1106.2°119.9°
N1C2O1120.9°119.9°
N1C2N3111.4°120.1°
O1C2N3125.9°120.0°
C2N3C6121.1°120.0°
C2N3HN3114.1°120.0°
C6N3HN3124.8°120.0°
N3C6C11107.7°109.5°
N3C6H61112.9°109.5°
N3C6H62112.9°109.5°
C11C6H61112.9°109.4°
C11C6H62112.9°109.5°
C6C11C7121.0°120.0°
C6C11C9120.0°120.0°
H61C6H6297.6°109.4°
C11C7C15119.7°120.0°
C11C7H7120.1°120.0°
C7C11C9119.0°120.0°
C15C7H7120.1°119.9°
C7C15C10123.0°120.0°
C7C15H2119.5°120.1°
C11C9C12119.9°120.0°
C11C9H9119.8°120.0°
C12C9H9120.3°120.0°
C9C12C10121.6°120.0°
C9C12H12118.6°120.1°
C10C12H12119.7°119.9°
C12C10C15116.6°120.0°
C12C10H10123.2°120.0°
C15C10H10120.2°120.0°
C10C15H2117.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N2C1C5H1180.0°179.9°
C1N2C3C13167.8°179.9°
C1N2C3N43.2°0.2°
C1N2C3H3176.8°180.0°
N2C1C5N42.3°0.2°
N2C1C5C8173.8°180.0°
C1N2C13C1495.8°119.9°
C1N2C13C1827.8°120.0°
C1N2C13H13147.7°0.1°
C5C1N2C33.3°0.0°
C5C1N2C13170.5°180.0°
C1C5N4C30.4°0.4°
C1C5N4C8176.5°179.8°
C1C5C8O91.2°0.1°
C1C5C8N10174.6°180.0°
H1C1N2C3176.6°180.0°
H1C1N2C139.4°0.1°
H1C1C5N4177.6°179.8°
H1C1C5C86.2°0.1°
N2C3N4H3180.0°179.8°
N2C3N4C51.9°0.3°
C3N2C13C1499.9°60.0°
C3N2C13C18136.6°60.1°
C3N2C13H1316.7°180.0°
C13N2C3N4171.0°179.7°
C13N2C3H39.0°0.1°
N2C13C14C18124.8°120.1°
N2C13C14H13115.2°120.0°
N2C13C18H13115.6°119.9°
N2C13C14O1552.1°60.0°
N2C13C14H141177.4°180.0°
N2C13C14H14273.2°59.9°
N2C13C18C1983.0°180.0°
N2C13C18H18142.3°60.0°
N2C13C18H182151.7°60.1°
C3N4C5C8176.1°179.9°
H3C3N4C5178.1°179.9°
N4C5C8O9176.7°179.7°
N4C5C8N109.9°0.3°
C5C8O9N10172.8°179.9°
C5C8N10H101180.0°180.0°
C5C8N10H1027.5°0.4°
O9C8N10H1017.5°0.1°
O9C8N10H102180.0°179.7°
C8N10H101H102173.4°179.6°
C14C13C18H13117.2°120.0°
C13C14O15H141125.3°120.1°
C13C14O15H142125.3°120.0°
C13C14H141H142112.3°120.1°
C13C14O15H15180.0°180.0°
C14C13C18C19149.7°59.9°
C14C13C18H18185.0°179.9°
C14C13C18H18224.5°60.0°
C18C13C14O15176.9°60.0°
C18C13C14H14157.9°60.0°
C18C13C14H14251.6°180.0°
C13C18C19H181125.3°120.0°
C13C18C19H182125.3°120.0°
C13C18H181H182117.3°120.0°
C13C18C19N22167.0°180.0°
C13C18C19H19167.7°60.0°
C13C18C19H19241.8°60.0°
H13C13C14O1563.1°180.0°
H13C13C14H14162.2°60.0°
H13C13C14H142171.7°60.1°
H13C13C18C1932.6°60.0°
H13C13C18H181157.9°60.0°
H13C13C18H18292.7°NaN°
O15C14H141H142112.3°119.9°
H141C14O15H1554.7°60.0°
H142C14O15H1554.7°60.0°
C19C18H181H182117.3°120.0°
C18C19N22H191125.3°120.0°
C18C19N22H192125.2°120.0°
C18C19H191H192118.2°120.0°
C18C19N22C27102.9°90.0°
C18C19N22C3074.6°90.3°
H181C18C19N2241.7°60.0°
H181C18C19H191167.0°180.0°
H181C18C19H19283.5°60.0°
H182C18C19N2267.7°60.0°
H182C18C19H19157.5°60.0°
H182C18C19H192167.0°180.0°
N22C19H191H192118.3°120.0°
C19N22C27C30177.8°179.8°
C19N22C27C28176.6°180.0°
C19N22C27H273.4°0.1°
C19N22C30C29177.0°179.8°
C19N22C30C344.5°0.7°
H191C19N22C2722.4°150.0°
H191C19N22C30160.2°29.8°
H192C19N22C27131.9°30.0°
H192C19N22C3050.7°149.8°
N22C27C28H27180.0°179.9°
N22C27C28C291.1°0.0°
N22C27C28H28178.9°180.0°
C27N22C30C290.7°0.4°
C27N22C30C34177.8°179.5°
C30N22C27C281.2°0.2°
C30N22C27H27178.9°179.7°
N22C30C29C280.1°0.4°
N22C30C29C34178.7°179.3°
N22C30C29C31177.3°179.8°
N22C30C34C33178.3°179.6°
N22C30C34H341.7°0.7°
C27C28C29H28180.0°179.9°
C27C28C29C300.6°0.3°
C27C28C29C31176.1°180.0°
H27C27C28C29178.9°180.0°
H27C27C28H281.0°0.1°
C28C29C30C31177.2°179.8°
C28C29C30C34178.6°179.7°
C28C29C31C32177.2°180.0°
C28C29C31H312.8°0.0°
H28C28C29C30179.4°179.8°
H28C28C29C313.9°0.1°
C30C29C31C320.8°0.2°
C30C29C31H31179.2°179.7°
C29C30C34C330.0°0.5°
C29C30C34H34180.0°179.8°
C31C29C30C341.4°0.5°
C29C31C32H31180.0°179.9°
C29C31C32C331.0°0.1°
C29C31C32H32179.0°180.0°
C30C34C33C321.9°0.2°
C30C34C33H34180.0°179.8°
C30C34C33N1174.4°179.8°
C31C32C33H32180.0°179.9°
C31C32C33C342.4°0.1°
C31C32C33N1174.0°180.0°
H31C31C32C33179.0°180.0°
H31C31C32H321.0°0.0°
C32C33C34N1172.5°179.9°
C32C33C34H34178.1°179.9°
C32C33N1C215.4°38.7°
C32C33N1HN1109.8°141.2°
H32C32C33C34177.6°180.0°
H32C32C33N16.0°0.0°
C34C33N1C2172.6°141.3°
C34C33N1HN162.2°38.8°
N1C33C34H345.6°0.0°
C33N1C2HN1125.3°179.9°
C33N1C2O113.3°5.8°
C33N1C2N3179.1°174.3°
N1C2O1N3163.5°179.9°
N1C2N3C6169.3°180.0°
N1C2N3HN310.7°0.0°
HN1N1C2O1111.9°174.3°
HN1N1C2N353.8°5.6°
O1C2N3C64.4°0.0°
O1C2N3HN3175.6°180.0°
C2N3C6HN3180.0°180.0°
C2N3C6C11103.5°180.0°
C2N3C6H61131.2°60.0°
C2N3C6H6221.7°60.0°
N3C6C11H61125.3°120.0°
N3C6C11H62125.3°120.0°
N3C6H61H62118.8°120.0°
N3C6C11C737.2°90.0°
N3C6C11C9143.4°90.3°
HN3N3C6C1176.4°0.0°
HN3N3C6H6148.9°120.0°
HN3N3C6H62158.3°120.0°
C11C6H61H62118.8°120.0°
C6C11C7C9179.4°179.7°
C6C11C7C15179.2°180.0°
C6C11C7H70.8°0.0°
C6C11C9C12178.6°179.8°
C6C11C9H91.3°0.3°
H61C6C11C788.0°150.0°
H61C6C11C991.3°29.7°
H62C6C11C7162.5°30.0°
H62C6C11C918.1°149.7°
C11C7C15H7180.0°180.0°
C7C11C9C122.0°0.5°
C7C11C9H9178.0°180.0°
C11C7C15C104.1°0.1°
C11C7C15H2175.9°180.0°
C15C7C11C90.2°0.3°
C7C15C10C125.3°0.0°
C7C15C10H2180.0°179.9°
C7C15C10H10174.7°180.0°
H7C7C11C9179.8°179.7°
H7C7C15C10175.9°180.0°
H7C7C15H24.1°0.0°
C11C9C12H9180.0°179.5°
C11C9C12C100.6°0.5°
C11C9C12H12179.4°179.7°
C9C12C10H12180.0°179.8°
C9C12C10C153.0°0.2°
C9C12C10H10177.0°179.8°
H9C9C12C10179.5°180.0°
H9C9C12H120.6°0.2°
C12C10C15H10180.0°179.9°
C12C10C15H2174.6°180.0°
H12C12C10C15177.0°179.9°
H12C12C10H103.0°0.0°
H10C10C15H25.3°0.1°

226262

PDB entries from 2024-10-16

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