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Y1K

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2doub1.39Å1.40ÅAromatic
C1C24sing1.40Å1.42ÅAromatic
C1C25sing1.48Å1.50Å
C2C3sing1.39Å1.37ÅAromatic
C3C4sing1.48Å1.45Å
C3C21doub1.40Å1.40ÅAromatic
C4C5doub1.39Å1.40ÅAromatic
C4C11sing1.40Å1.39ÅAromatic
C5C6sing1.38Å1.38ÅAromatic
C6CL7sing1.74Å1.73Å
C6C8doub1.39Å1.40ÅAromatic
C8C9sing1.51Å1.51Å
C8C10sing1.38Å1.37ÅAromatic
C10C11doub1.39Å1.41ÅAromatic
C11O12sing1.36Å1.39Å
O12C13sing1.43Å1.43Å
C13C14sing1.51Å1.53Å
C14N15sing1.37Å1.42Å
C14N18doub1.29Å1.33Å
N15C16sing1.35Å1.41Å
N15C20sing1.47Å1.45Å
C16N17sing1.35Å1.39Å
C16O19doub1.22Å1.18Å
N17N18sing1.40Å1.36Å
C21F22sing1.35Å1.33Å
C21C23sing1.39Å1.46ÅAromatic
C23C24doub1.38Å1.40ÅAromatic
C25N26sing1.35Å1.38Å
C25O34doub1.22Å1.26Å
N26C27sing1.47Å1.50Å
N26C31sing1.47Å1.47Å
C27C28sing1.53Å1.54Å
C28N29sing1.46Å1.49Å
N29C30sing1.33Å1.40Å
N29C33sing1.46Å1.50Å
C30C31sing1.50Å1.52Å
C30O32doub1.21Å1.20Å
C10H40sing1.08Å1.08Å
C13H42sing1.09Å1.10Å
C13H41sing1.09Å1.10Å
C20H44sing1.09Å1.10Å
C20H46sing1.09Å1.10Å
C20H45sing1.09Å1.10Å
C23H47sing1.08Å1.08Å
C24H48sing1.08Å1.08Å
C27H49sing1.09Å1.10Å
C27H50sing1.09Å1.10Å
C28H51sing1.09Å1.10Å
C28H52sing1.09Å1.10Å
C2H35sing1.08Å1.08Å
C5H36sing1.08Å1.08Å
C9H37sing1.09Å1.10Å
C9H38sing1.09Å1.10Å
C9H39sing1.09Å1.10Å
N17H43sing0.97Å1.00Å
C31H54sing1.09Å1.10Å
C31H53sing1.09Å1.10Å
C33H56sing1.09Å1.10Å
C33H57sing1.09Å1.10Å
C33H55sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C24121.7°119.9°
C2C1C25115.7°120.0°
C1C2C3121.1°119.8°
C1C2H35119.5°120.1°
C24C1C25122.4°120.1°
C1C24C23118.6°120.2°
C1C24H48120.7°120.0°
C1C25N26121.3°120.0°
C1C25O34120.9°120.0°
C2C3C4119.9°120.1°
C2C3C21118.7°119.9°
C3C2H35119.5°120.1°
C4C3C21121.4°120.1°
C3C4C5120.4°120.2°
C3C4C11120.0°120.1°
C3C21F22118.7°120.0°
C3C21C23122.3°120.1°
C5C4C11119.6°119.7°
C4C5C6117.4°119.9°
C4C5H36121.3°120.1°
C4C11C10121.7°119.8°
C4C11O12114.8°120.2°
C5C6CL7116.9°119.9°
C5C6C8123.9°120.2°
C6C5H36121.3°120.0°
CL7C6C8119.1°119.9°
C6C8C9122.8°119.9°
C6C8C10118.5°120.2°
C9C8C10118.7°119.9°
C8C9H37109.5°109.4°
C8C9H38109.5°109.4°
C8C9H39109.5°109.5°
C8C10C11118.8°120.1°
C8C10H40120.6°119.9°
C10C11O12123.5°120.1°
C11C10H40120.6°120.0°
C11O12C13113.9°117.0°
O12C13C14109.6°109.5°
O12C13H42109.4°109.5°
O12C13H41109.4°109.5°
C13C14N15123.8°125.6°
C13C14N18125.6°125.6°
C14C13H42109.5°109.5°
C14C13H41109.4°109.5°
N15C14N18110.6°108.8°
C14N15C16106.5°108.3°
C14N15C20129.1°125.8°
C14N18N17106.5°108.1°
C16N15C20124.4°125.8°
N15C16N17104.3°107.4°
N15C16O19127.4°126.3°
N15C20H44109.5°109.5°
N15C20H46109.5°109.5°
N15C20H45109.4°109.5°
N17C16O19128.3°126.3°
C16N17N18112.1°107.3°
C16N17H43124.0°126.3°
N18N17H43123.9°126.4°
F22C21C23119.0°119.9°
C21C23C24117.6°120.2°
C21C23H47121.2°119.9°
C24C23H47121.2°119.9°
C23C24H48120.7°119.9°
N26C25O34117.8°120.0°
C25N26C27123.0°121.3°
C25N26C31118.6°121.3°
C27N26C31118.4°117.3°
N26C27C28114.6°108.2°
N26C27H49108.2°109.7°
N26C27H50108.2°109.7°
N26C31C30112.1°108.9°
N26C31H54108.8°109.6°
N26C31H53108.8°109.6°
C27C28N29106.8°110.8°
C28C27H49108.2°109.7°
C28C27H50108.2°109.7°
C27C28H51110.1°109.3°
C27C28H52110.2°109.2°
C28N29C30113.2°124.5°
C28N29C33115.3°117.7°
N29C28H51110.1°109.2°
N29C28H52110.2°109.2°
C30N29C33119.6°117.7°
N29C30C31119.0°123.0°
N29C30O32123.5°118.5°
N29C33H56109.5°109.4°
N29C33H57109.5°109.5°
N29C33H55109.5°109.5°
C31C30O32117.3°118.5°
C30C31H54108.8°109.5°
C30C31H53108.8°109.5°
H42C13H41109.5°109.5°
H44C20H46109.5°109.5°
H44C20H45109.5°109.5°
H46C20H45109.5°109.5°
H49C27H50109.5°109.7°
H51C28H52109.5°109.1°
H37C9H38109.5°109.5°
H37C9H39109.5°109.5°
H38C9H39109.4°109.5°
H54C31H53109.5°109.7°
H56C33H57109.5°109.5°
H56C33H55109.5°109.5°
H57C33H55109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C24C25174.1°179.8°
C1C2C3H35180.0°179.7°
C1C2C3C4178.0°180.0°
C1C2C3C210.9°0.6°
C2C1C24C232.1°0.0°
C2C1C25N26139.1°147.6°
C2C1C25O3437.1°32.4°
C2C1C24H48177.9°180.0°
C24C1C2C31.2°0.3°
C1C24C23C211.0°0.0°
C1C24C23H48180.0°180.0°
C24C1C25N2646.5°32.2°
C24C1C25O34137.3°147.8°
C1C24C23H47179.0°180.0°
C24C1C2H35178.8°180.0°
C25C1C2C3173.3°180.0°
C25C1C24C23172.0°179.8°
C1C25N26O34176.3°180.0°
C1C25N26C273.9°173.8°
C1C25N26C31176.2°6.2°
C25C1C24H488.0°0.3°
C25C1C2H356.7°0.3°
C2C3C4C21178.8°179.5°
C2C3C4C569.3°65.0°
C2C3C4C11109.5°115.0°
C2C3C21F22177.6°179.7°
C2C3C21C232.0°0.6°
C3C4C5C11178.8°180.0°
C3C4C5C6177.2°180.0°
C3C4C11C10176.5°180.0°
C3C4C11O124.8°0.0°
C4C3C21F223.5°0.2°
C4C3C21C23176.8°180.0°
C4C3C2H352.0°0.3°
C3C4C5H362.8°0.0°
C21C3C4C5109.5°115.5°
C21C3C4C1171.7°64.5°
C3C21F22C23179.7°179.7°
C3C21C23C241.1°0.3°
C3C21C23H47178.9°179.7°
C21C3C2H35179.1°179.7°
C4C5C6H36180.0°180.0°
C4C5C6CL7179.8°179.9°
C4C5C6C80.1°0.3°
C5C4C11C102.3°0.0°
C5C4C11O12176.4°180.0°
C11C4C5C61.6°0.0°
C4C11C10C81.2°0.2°
C4C11C10O12178.5°179.9°
C4C11O12C13177.0°180.0°
C4C11C10H40178.8°180.0°
C11C4C5H36178.4°180.0°
C5C6CL7C8179.7°179.7°
C5C6C8C9176.0°180.0°
C5C6C8C101.2°0.5°
CL7C6C8C93.6°0.3°
CL7C6C8C10179.2°179.8°
CL7C6C5H360.2°0.1°
C6C8C9C10177.2°179.5°
C6C8C10C110.5°0.5°
C6C8C10H40179.5°179.7°
C8C6C5H36179.9°179.8°
C6C8C9H3791.5°90.0°
C6C8C9H38148.5°150.0°
C6C8C9H3928.5°30.0°
C9C8C10C11176.8°180.0°
C9C8C10H403.2°0.3°
C8C9H37H38120.0°119.9°
C8C9H37H39120.0°120.0°
C8C9H38H39120.0°120.1°
C8C10C11H40180.0°179.7°
C8C10C11O12177.4°179.7°
C10C8C9H3791.3°90.5°
C10C8C9H3828.8°29.4°
C10C8C9H39148.7°149.5°
C10C11O12C134.4°0.0°
C11O12C13C14179.7°180.0°
O12C11C10H402.6°0.0°
C11O12C13H4260.2°60.0°
C11O12C13H4159.7°60.0°
O12C13C14H42120.0°120.0°
O12C13C14H41120.0°120.0°
O12C13C14N1569.1°180.0°
O12C13C14N18113.9°0.4°
O12C13H42H41119.9°120.0°
C13C14N15N18177.4°179.7°
C13C14N15C16177.2°180.0°
C13C14N15C201.5°0.0°
C13C14N18N17176.9°179.9°
C14C13H42H41120.0°120.0°
C14N15C16C20178.8°180.0°
C14N15C16N170.2°0.0°
C14N15C16O19177.7°179.7°
N15C14N18N170.5°0.5°
N15C14C13H42170.9°60.0°
N15C14C13H4150.9°60.0°
C14N15C20H44180.0°90.0°
C14N15C20H4660.0°150.0°
C14N15C20H4560.0°30.0°
N18C14N15C160.2°0.3°
N18C14N15C20178.9°179.7°
C14N18N17C160.6°0.5°
N18C14C13H426.1°120.4°
N18C14C13H41126.1°119.6°
C14N18N17H43179.4°179.5°
N15C16N17O19177.8°179.7°
N15C16N17N180.5°0.3°
C16N15C20H441.5°90.0°
C16N15C20H46118.5°30.0°
C16N15C20H45121.5°150.0°
N15C16N17H43179.5°179.7°
C20N15C16N17178.6°180.0°
C20N15C16O193.6°0.3°
N15C20H44H46120.0°120.0°
N15C20H44H45120.0°120.0°
N15C20H46H45120.0°120.0°
C16N17N18H43180.0°180.0°
O19C16N17N18177.3°180.0°
O19C16N17H432.7°0.0°
F22C21C23C24178.6°180.0°
F22C21C23H471.4°0.0°
C21C23C24H47180.0°180.0°
C21C23C24H48179.0°180.0°
C25N26C27C31179.8°180.0°
C25N26C27C28173.1°118.5°
C25N26C31C30144.0°137.3°
C25N26C27H4952.4°1.2°
C25N26C27H5066.2°121.9°
C25N26C31H5495.6°17.5°
C25N26C31H5323.6°103.0°
O34C25N26C27172.4°6.2°
O34C25N26C317.4°173.8°
N26C27C28H49120.7°119.7°
N26C27C28H50120.8°119.7°
N26C27C28N2941.6°46.7°
C27N26C31C3036.2°42.7°
N26C27H49H50117.7°120.7°
N26C27C28H51161.1°167.0°
N26C27C28H5278.0°73.7°
C27N26C31H5484.2°162.5°
C27N26C31H53156.6°77.0°
C31N26C27C287.1°61.5°
N26C31C30N2914.9°12.7°
N26C31C30H54120.4°119.8°
N26C31C30H53120.4°119.8°
N26C31C30O32168.0°167.3°
C31N26C27H49127.8°178.8°
C31N26C27H50113.7°58.2°
N26C31H54H53118.8°120.4°
C27C28N29H51119.6°120.4°
C27C28N29H52119.6°120.4°
C27C28N29C3064.1°21.9°
C27C28N29C33152.9°158.1°
C28C27H49H50117.7°120.6°
C27C28H51H52121.3°119.4°
C28N29C30C33141.3°179.9°
C28N29C30C3136.3°4.3°
C28N29C30O32140.6°175.7°
N29C28C27H4979.1°166.4°
N29C28C27H50162.3°73.0°
N29C28H51H52121.3°119.3°
C28N29C33H56180.0°90.0°
C28N29C33H5760.0°150.0°
C28N29C33H5560.0°29.9°
N29C30C31O32177.1°180.0°
C30N29C28H51176.3°142.2°
C30N29C28H5255.5°98.5°
N29C30C31H54105.5°132.5°
N29C30C31H53135.3°107.1°
C30N29C33H5639.5°90.0°
C30N29C33H57159.5°29.9°
C30N29C33H5580.5°150.0°
C33N29C30C31177.6°175.7°
C33N29C30O320.7°4.4°
C33N29C28H5133.3°37.7°
C33N29C28H5287.5°81.6°
N29C33H56H57120.0°120.0°
N29C33H56H55120.0°120.0°
N29C33H57H55120.0°120.0°
C30C31H54H53118.8°120.2°
O32C30C31H5471.6°47.5°
O32C30C31H5347.6°72.9°
H44C20H46H45120.0°120.0°
H47C23C24H481.0°0.0°
H49C27C28H5140.4°73.3°
H49C27C28H52161.2°46.1°
H50C27C28H5178.1°47.4°
H50C27C28H5242.7°166.7°
H37C9H38H39120.0°120.0°
H56C33H57H55119.9°120.0°

250835

PDB entries from 2026-03-18

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