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A1C6Z

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1Cdoub1.38Å1.38ÅAromatic
C1C2sing1.38Å1.38ÅAromatic
CC5sing1.38Å1.39ÅAromatic
C2C3doub1.39Å1.39ÅAromatic
C5C4doub1.39Å1.39ÅAromatic
F1C22sing1.40Å1.32Å
C3C4sing1.39Å1.39ÅAromatic
C3O3sing1.36Å1.39Å
C4Nsing1.40Å1.43Å
C22O3sing1.43Å1.33Å
C22F2sing1.40Å1.30Å
C22F3sing1.40Å1.33Å
NC6sing1.35Å1.36ÅAromatic
NN1sing1.40Å1.37ÅAromatic
N4C6sing1.38Å1.36Å
C6C7doub1.39Å1.40ÅAromatic
N1C8doub1.30Å1.33ÅAromatic
C7C8sing1.42Å1.41ÅAromatic
C7C9sing1.47Å1.49Å
C9Odoub1.22Å1.22Å
C9N2sing1.35Å1.36Å
C10N2sing1.47Å1.47Å
C10C11sing1.53Å1.52Å
N2C14sing1.47Å1.47Å
C11C12sing1.53Å1.53Å
C14C13sing1.53Å1.52Å
C12C13sing1.53Å1.53Å
C13O2sing1.45Å1.48Å
C13C15sing1.51Å1.53Å
O2C21sing1.35Å1.36Å
FC20sing1.35Å1.34Å
O1C21doub1.21Å1.22Å
C21N3sing1.35Å1.34Å
C15C20doub1.38Å1.39ÅAromatic
C15C16sing1.39Å1.41ÅAromatic
C20C19sing1.39Å1.38ÅAromatic
N3C16sing1.40Å1.41Å
C16C17doub1.39Å1.40ÅAromatic
C19CLsing1.74Å1.73Å
C19C18doub1.38Å1.39ÅAromatic
C17C18sing1.38Å1.39ÅAromatic
CHsing1.08Å1.08Å
C1H1sing1.08Å1.08Å
C10H5sing1.09Å1.10Å
C10H6sing1.09Å1.10Å
C11H8sing1.09Å1.10Å
C11H7sing1.09Å1.10Å
C12H10sing1.09Å1.10Å
C12H9sing1.09Å1.10Å
C14H11sing1.09Å1.10Å
C14H12sing1.09Å1.10Å
C17H13sing1.08Å1.08Å
C18H14sing1.08Å1.08Å
C2H2sing1.08Å1.08Å
C5H3sing1.08Å1.08Å
C8H4sing1.08Å1.08Å
N3H15sing0.97Å1.00Å
N4H17sing0.97Å1.00Å
N4H16sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CC1C2120.6°120.2°
C1CC5120.8°120.2°
C1CH119.6°119.9°
CC1H1119.7°119.9°
C1C2C3118.6°120.0°
C2C1H1119.7°119.9°
C1C2H2120.7°120.0°
CC5C4119.2°120.0°
C5CH119.6°119.9°
CC5H3120.4°119.9°
C2C3C4121.0°119.8°
C2C3O3121.3°120.1°
C3C2H2120.7°120.0°
C5C4C3119.4°119.8°
C5C4N119.4°120.1°
C4C5H3120.4°120.0°
F1C22O3113.2°109.5°
F1C22F2107.3°109.5°
F1C22F3107.3°109.5°
C4C3O3117.2°120.1°
C3C4N121.1°120.1°
C3O3C22118.1°117.0°
C4NC6128.4°125.7°
C4NN1119.4°125.8°
O3C22F2109.3°109.5°
O3C22F3112.1°109.4°
F2C22F3107.4°109.5°
C6NN1112.0°108.5°
NC6N4123.6°126.5°
NC6C7106.5°107.1°
NN1C8104.7°109.3°
N4C6C7129.9°126.4°
C6N4H17109.5°120.0°
C6N4H16109.5°120.1°
C6C7C8104.5°106.9°
C6C7C9122.6°126.6°
N1C8C7112.2°108.2°
N1C8H4123.9°125.9°
C8C7C9132.7°126.5°
C7C8H4123.9°125.9°
C7C9O117.5°120.0°
C7C9N2120.7°120.0°
OC9N2121.7°120.1°
C9N2C10127.0°120.7°
C9N2C14120.7°120.6°
N2C10C11110.6°108.8°
C10N2C14112.3°118.7°
N2C10H5109.2°109.6°
N2C10H6109.2°109.6°
C10C11C12110.1°109.3°
C11C10H5109.2°109.6°
C11C10H6109.2°109.6°
C10C11H8109.3°109.5°
C10C11H7109.3°109.5°
N2C14C13109.5°108.9°
N2C14H11109.5°109.6°
N2C14H12109.5°109.6°
C11C12C13111.7°109.6°
C12C11H8109.3°109.5°
C12C11H7109.3°109.5°
C11C12H10108.9°109.4°
C11C12H9108.9°109.4°
C14C13C12111.6°109.5°
C14C13O2104.8°109.5°
C14C13C15114.0°109.5°
C13C14H11109.4°109.6°
C13C14H12109.4°109.6°
C12C13O2105.9°109.6°
C12C13C15111.2°109.6°
C13C12H10108.9°109.5°
C13C12H9108.9°109.5°
O2C13C15108.8°109.1°
C13O2C21120.1°117.3°
C13C15C20124.2°120.8°
C13C15C16116.6°119.1°
O2C21O1117.9°119.7°
O2C21N3116.5°120.6°
FC20C15121.0°120.1°
FC20C19117.4°120.1°
O1C21N3125.1°119.7°
C21N3C16123.5°119.8°
C21N3H15118.2°120.1°
C20C15C16118.9°120.1°
C15C20C19121.5°119.8°
C15C16N3119.5°119.3°
C15C16C17119.6°119.9°
C20C19CL119.3°119.9°
C20C19C18119.7°120.1°
N3C16C17120.9°120.8°
C16N3H15118.2°120.1°
C16C17C18120.1°119.8°
C16C17H13120.0°120.1°
CLC19C18121.0°119.9°
C19C18C17120.1°120.2°
C19C18H14119.9°119.9°
C18C17H13119.9°120.1°
C17C18H14119.9°119.9°
H5C10H6109.5°109.7°
H8C11H7109.5°109.5°
H10C12H9109.4°109.4°
H11C14H12109.5°109.5°
H17N4H16109.4°119.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CC1C2H1180.0°180.0°
C1CC5H180.0°179.7°
CC1C2C31.8°0.0°
C1CC5C43.3°0.0°
CC1C2H2178.2°180.0°
C1CC5H3176.7°179.7°
C2C1CC53.3°0.0°
C1C2C3H2180.0°180.0°
C1C2C3C47.0°0.0°
C1C2C3O3163.7°180.0°
C2C1CH176.7°179.7°
CC5C4H3180.0°179.7°
CC5C4C31.7°0.0°
CC5C4N173.8°180.0°
C5CC1H1176.7°180.0°
C2C3C4C56.9°0.0°
C2C3C4O3171.1°180.0°
C2C3C4N168.5°180.0°
C2C3O3C2270.6°0.0°
C3C2C1H1178.2°180.0°
C5C4C3N175.4°180.0°
C5C4C3O3164.2°180.0°
C5C4NC671.2°48.1°
C5C4NN1104.1°131.5°
C4C5CH176.6°179.7°
F1C22O3C342.3°180.0°
F1C22O3F2119.5°120.0°
F1C22O3F3121.5°120.0°
F1C22F2F3115.1°120.0°
C4C3O3C22100.4°179.9°
C3C4NC6113.4°131.9°
C3C4NN171.3°48.5°
C4C3C2H2173.1°180.0°
C3C4C5H3178.3°179.7°
O3C3C4N20.4°0.0°
C3O3C22F277.2°60.0°
C3O3C22F3163.9°60.0°
O3C3C2H216.2°0.0°
C4NC6N1175.6°179.7°
C4NC6N48.7°0.3°
C4NC6C7173.6°179.7°
C4NN1C8173.3°179.7°
NC4C5H36.2°0.3°
O3C22F2F3121.8°120.0°
NC6N4C7177.1°179.9°
C6NN1C82.8°0.1°
NC6C7C80.4°0.1°
NC6C7C9175.8°180.0°
NC6N4H17180.0°4.6°
NC6N4H1660.0°175.4°
N1NC6N4175.7°180.0°
N1NC6C72.0°0.1°
NN1C8C72.5°0.0°
NN1C8H4177.5°180.0°
N4C6C7C8177.1°180.0°
N4C6C7C91.6°0.0°
C6N4H17H16120.0°180.0°
C6C7C8N11.4°0.0°
C6C7C8C9174.8°180.0°
C6C7C9O33.1°42.5°
C6C7C9N2145.4°137.5°
C6C7C8H4178.6°180.0°
C7C6N4H172.9°175.5°
C7C6N4H16122.9°4.5°
N1C8C7H4180.0°180.0°
N1C8C7C9173.4°180.0°
C8C7C9O141.0°137.6°
C8C7C9N240.5°42.4°
C7C9ON2178.5°180.0°
C7C9N2C1015.5°5.0°
C7C9N2C14165.5°175.1°
C9C7C8H46.5°0.0°
OC9N2C10162.9°175.0°
OC9N2C1416.1°4.9°
C9N2C10C14179.1°179.9°
C9N2C10C11119.4°126.3°
C9N2C14C13120.8°126.4°
C9N2C10H50.7°113.9°
C9N2C10H6120.4°6.4°
C9N2C14H11119.1°6.6°
C9N2C14H120.8°113.7°
N2C10C11H5120.2°119.8°
N2C10C11H6120.2°119.8°
N2C10C11C1256.0°54.7°
C10N2C14C1360.0°53.4°
N2C10H5H6119.5°120.3°
N2C10C11H864.1°65.3°
N2C10C11H7176.1°174.6°
C10N2C14H1160.0°173.3°
C10N2C14H12180.0°66.5°
C11C10N2C1461.5°53.6°
C10C11C12H8120.1°120.0°
C10C11C12H7120.1°119.9°
C10C11C12C1351.8°61.2°
C11C10H5H6119.5°120.4°
C10C11H8H7119.7°120.1°
C10C11C12H10172.2°178.7°
C10C11C12H968.5°58.8°
N2C14C13H11120.0°119.8°
N2C14C13H12120.0°119.9°
N2C14C13C1254.6°54.4°
N2C14C13O259.6°65.7°
N2C14C13C15178.4°174.7°
C14N2C10H5178.3°66.2°
C14N2C10H658.7°173.4°
N2C14H11H12120.0°120.3°
C11C12C13C1451.8°61.1°
C11C12C13H10120.4°120.1°
C11C12C13H9120.4°120.0°
C11C12C13O261.7°59.0°
C11C12C13C15179.7°178.7°
C12C11C10H5176.2°65.1°
C12C11C10H664.2°174.5°
C12C11H8H7119.7°120.1°
C11C12H10H9119.0°119.9°
C14C13C12O2113.5°120.1°
C14C13C12C15128.5°120.2°
C14C13O2C15122.3°119.9°
C14C13O2C21168.6°75.2°
C14C13C15C2038.5°87.6°
C14C13C15C16147.7°92.3°
C14C13C12H10172.2°178.8°
C14C13C12H968.5°58.9°
C13C14H11H12119.9°120.3°
C12C13O2C15119.6°120.0°
C12C13O2C2173.2°164.7°
C12C13C15C2088.7°32.6°
C12C13C15C1685.1°147.5°
C13C12C11H868.3°58.8°
C13C12C11H7171.9°178.9°
C13C12H10H9119.0°120.0°
C12C13C14H1165.5°174.2°
C12C13C14H12174.6°65.5°
C13O2C21O1154.6°143.3°
C13O2C21N332.9°36.7°
O2C13C15C20155.1°152.6°
O2C13C15C1631.1°27.5°
O2C13C12H1058.7°61.1°
O2C13C12H9178.0°179.0°
O2C13C14H11179.6°54.1°
O2C13C14H1260.4°174.3°
C15C13O2C2146.3°44.7°
C13C15C20F2.6°0.5°
C13C15C20C16173.7°179.9°
C13C15C20C19174.9°179.5°
C13C15C16N36.1°1.8°
C13C15C16C17172.5°179.2°
C15C13C12H1059.3°58.6°
C15C13C12H960.0°61.3°
C15C13C14H1161.5°65.5°
C15C13C14H1258.4°54.7°
O2C21O1N3171.8°180.0°
O2C21N3C162.1°6.9°
O2C21N3H15177.9°173.1°
FC20C15C19177.5°179.9°
FC20C15C16176.3°179.6°
FC20C19CL6.6°0.1°
FC20C19C18175.2°179.9°
O1C21N3C16174.0°173.1°
O1C21N3H156.0°6.9°
C21N3C16C1510.7°10.5°
C21N3C16H15180.0°180.0°
C21N3C16C17170.8°168.6°
C20C15C16N3179.8°178.3°
C20C15C16C171.7°0.8°
C15C20C19CL175.8°180.0°
C15C20C19C182.4°0.0°
C16C15C20C191.2°0.5°
C15C16N3C17178.5°179.0°
C15C16C17C183.4°0.5°
C15C16C17H13176.5°179.4°
C15C16N3H15169.2°169.5°
C20C19CLC18178.1°180.0°
C20C19C18C170.6°0.2°
C20C19C18H14179.4°179.7°
N3C16C17C18178.1°178.5°
N3C16C17H131.9°1.5°
C16C17C18C192.3°0.1°
C16C17C18H13180.0°180.0°
C16C17C18H14177.7°180.0°
C17C16N3H159.2°11.5°
CLC19C18C17177.5°179.8°
CLC19C18H142.5°0.3°
C19C18C17H14180.0°180.0°
C19C18C17H13177.7°179.9°
HCC1H13.3°0.3°
HCC5H33.3°0.0°
H1C1C2H21.8°0.0°
H5C10C11H856.1°174.9°
H5C10C11H763.7°54.8°
H6C10C11H8175.8°54.6°
H6C10C11H756.0°65.5°
H8C11C12H1052.1°61.3°
H8C11C12H9171.4°178.8°
H7C11C12H1067.7°58.8°
H7C11C12H951.5°61.1°
H13C17C18H142.3°0.1°

250835

PDB entries from 2026-03-18

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