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L0I

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C2O1doub1.22Å1.21Å
N3C2sing1.35Å1.34Å
C2N7sing1.35Å1.32Å
C4N3sing1.46Å1.44Å
N3H32sing0.97Å1.00Å
C5C4sing1.53Å1.49Å
C6C4sing1.53Å1.50Å
H33C4sing1.09Å1.10Å
H34C5sing1.09Å1.10Å
C5H35sing1.09Å1.10Å
C5C6sing1.53Å1.49Å
H37C6sing1.09Å1.10Å
C6H36sing1.09Å1.10Å
H38N7sing0.97Å1.00Å
N7C8sing1.41Å1.37Å
C13C8sing1.41Å1.38ÅAromatic
C8C9doub1.36Å1.36ÅAromatic
C9N10sing1.36Å1.34ÅAromatic
C9H39sing1.08Å1.08Å
N12N10sing1.40Å1.35ÅAromatic
N10H11sing0.97Å1.00Å
C13N12doub1.32Å1.33ÅAromatic
C14C13sing1.48Å1.44ÅAromatic
N15C14doub1.31Å1.33ÅAromatic
C14N30sing1.37Å1.35ÅAromatic
C16N15sing1.35Å1.34ÅAromatic
C17C16doub1.40Å1.39ÅAromatic
C16C29sing1.41Å1.39ÅAromatic
H40C17sing1.08Å1.08Å
C18C17sing1.38Å1.38ÅAromatic
H41C18sing1.08Å1.08Å
C18C19doub1.39Å1.40ÅAromatic
C20C19sing1.51Å1.52Å
C19C28sing1.38Å1.39ÅAromatic
N21C20sing1.47Å1.50Å
H43C20sing1.09Å1.10Å
C20H42sing1.09Å1.10Å
H22N21sing1.01Å1.00Å
C27N21sing1.47Å1.50Å
N21C23sing1.47Å1.50Å
C24C23sing1.53Å1.53Å
C23H44sing1.09Å1.10Å
C23H45sing1.09Å1.10Å
H46C24sing1.09Å1.10Å
O25C24sing1.43Å1.44Å
C24H47sing1.09Å1.10Å
C26O25sing1.43Å1.44Å
H48C26sing1.09Å1.10Å
H49C26sing1.09Å1.10Å
C26C27sing1.53Å1.53Å
H51C27sing1.09Å1.10Å
C27H50sing1.09Å1.10Å
C28C29doub1.39Å1.39ÅAromatic
C28H52sing1.08Å1.08Å
C29N30sing1.38Å1.37ÅAromatic
N30H31sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1C2N3128.6°120.0°
O1C2N7125.6°120.0°
N3C2N7105.0°120.0°
C2N3C4125.4°120.0°
C2N3H32117.3°120.0°
C2N7H38113.5°120.0°
C2N7C8132.9°120.0°
C4N3H32117.3°120.0°
N3C4C5111.3°117.5°
N3C4C6116.0°117.5°
N3C4H3397.4°115.6°
C5C4C659.6°60.0°
C5C4H33137.4°117.5°
C4C5H34130.7°117.5°
C4C5H35135.8°117.5°
C4C5C660.3°60.0°
C6C4H33133.5°117.5°
C4C6C560.1°60.0°
C4C6H37130.8°117.5°
C4C6H36135.9°117.5°
H34C5H3575.0°115.5°
H34C5C6130.7°117.5°
H35C5C6135.8°117.5°
C5C6H37130.8°117.5°
C5C6H36135.9°117.5°
H37C6H3674.9°115.5°
H38N7C8113.6°119.9°
N7C8C13120.6°126.1°
N7C8C9132.4°126.1°
C13C8C9106.8°107.8°
C8C13N12110.0°108.0°
C8C13C14126.5°126.0°
C8C9N10106.3°107.8°
C8C9H39126.8°126.1°
N10C9H39126.8°126.1°
C9N10N12111.6°108.2°
C9N10H11124.2°125.9°
N12N10H11124.2°125.9°
N10N12C13105.3°108.2°
N12C13C14123.5°126.0°
C13C14N15125.7°125.1°
C13C14N30122.8°125.1°
N15C14N30111.4°109.8°
C14N15C16106.0°109.6°
C14N30C29107.1°107.2°
C14N30H31126.5°126.4°
N15C16C17130.9°133.4°
N15C16C29109.9°107.2°
C17C16C29119.2°119.4°
C16C17H40120.7°120.1°
C16C17C18118.7°119.7°
C16C29C28122.4°120.0°
C16C29N30105.6°106.2°
H40C17C18120.6°120.1°
C17C18H41118.9°119.7°
C17C18C19122.2°120.6°
H41C18C19118.9°119.8°
C18C19C20119.9°119.8°
C18C19C28119.3°120.5°
C20C19C28120.7°119.8°
C19C20N21118.4°109.5°
C19C20H43106.6°109.5°
C19C20H42104.5°109.5°
C19C28C29118.2°119.8°
C19C28H52120.9°120.0°
N21C20H43106.6°109.5°
N21C20H42104.5°109.4°
C20N21H22106.0°109.5°
C20N21C27110.9°109.5°
C20N21C23113.4°109.5°
H43C20H42116.8°109.5°
H22N21C27109.3°109.4°
H22N21C23106.7°109.5°
C27N21C23110.3°109.4°
N21C27C26109.6°109.4°
N21C27H51109.4°109.5°
N21C27H50109.4°109.4°
N21C23C24112.8°109.4°
N21C23H44108.4°109.5°
N21C23H45107.7°109.5°
C24C23H44108.4°109.5°
C24C23H45107.6°109.5°
C23C24H46108.0°109.5°
C23C24O25114.1°109.2°
C23C24H47106.9°109.5°
H44C23H45112.1°109.5°
H46C24O25108.0°109.5°
H46C24H47113.1°109.5°
O25C24H47106.9°109.5°
C24O25C26111.0°113.7°
O25C26H48108.5°109.5°
O25C26H49107.9°109.5°
O25C26C27112.3°109.3°
H48C26H49111.7°109.6°
H48C26C27108.5°109.5°
H49C26C27107.9°109.5°
C26C27H51109.4°109.5°
C26C27H50109.4°109.5°
H51C27H50109.6°109.5°
C29C28H52120.9°120.1°
C28C29N30132.0°133.8°
C29N30H31126.5°126.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1C2N3N7170.1°179.6°
O1C2N3C464.4°0.1°
O1C2N3H32115.6°180.0°
O1C2N7H38166.5°180.0°
O1C2N7C813.5°0.1°
C2N3C4H32180.0°179.9°
C2N3C4C597.0°155.0°
C2N3C4C6162.5°136.4°
C2N3C4H3350.9°9.4°
N3C2N7H384.0°0.4°
N3C2N7C8175.9°179.7°
N7C2N3C4125.5°179.7°
N7C2N3H3254.5°0.4°
C2N7H38C8180.0°179.9°
C2N7C8C13152.6°179.7°
C2N7C8C932.5°0.1°
N3C4C5C6108.5°107.5°
N3C4C5H33128.8°145.0°
N3C4C6H33131.2°145.1°
N3C4C5H34131.5°145.0°
N3C4C5H3518.2°0.0°
N3C4C6H3719.6°145.0°
N3C4C6H36132.8°0.0°
H32N3C4C583.0°25.1°
H32N3C4C617.5°43.6°
H32N3C4H33129.1°170.7°
C5C4C6H33128.3°107.4°
C4C5H34H35138.5°145.7°
C4C5H34C683.0°68.6°
C4C5H35C692.2°68.6°
C5C4C6H37120.0°107.5°
C4C5C6H36126.7°107.5°
C4C6H37H36138.5°145.7°
H33C4C5H342.7°0.0°
H33C4C5H35110.6°145.0°
H33C4C6H37111.6°0.1°
H33C4C6H361.6°145.1°
H34C5H35C6133.9°145.7°
H34C5C6H37120.0°0.0°
H34C5C6H366.7°145.0°
H35C5C6H376.7°145.0°
H35C5C6H36106.6°0.0°
C5C6H37H36138.6°145.7°
H38N7C8C1327.4°0.3°
H38N7C8C9147.5°180.0°
N7C8C13C9176.0°179.8°
N7C8C9N10177.0°180.0°
N7C8C9H393.0°0.0°
N7C8C13N12177.9°179.8°
N7C8C13C142.9°0.0°
C13C8C9N101.6°0.3°
C13C8C9H39178.4°179.8°
C8C13N12N101.3°0.5°
C8C13N12C14179.2°179.8°
C8C13C14N1510.5°0.3°
C8C13C14N30168.7°180.0°
C8C9N10H39180.0°180.0°
C8C9N10N120.9°0.0°
C8C9N10H11179.1°180.0°
C9C8C13N121.8°0.5°
C9C8C13C14179.0°179.7°
C9N10N12H11180.0°180.0°
C9N10N12C130.2°0.3°
H39C9N10N12179.1°180.0°
H39C9N10H111.0°0.0°
N10N12C13C14179.5°179.7°
H11N10N12C13179.8°179.7°
N12C13C14N15168.6°179.5°
N12C13C14N3012.2°0.2°
C13C14N15N30179.2°179.7°
C13C14N15C16179.8°180.0°
C13C14N30C29179.8°179.9°
C13C14N30H310.2°0.0°
C14N15C16C17179.5°179.9°
C14N15C16C290.0°0.0°
N15C14N30C290.9°0.4°
N15C14N30H31179.1°179.7°
N30C14N15C160.6°0.3°
C14N30C29C160.9°0.4°
C14N30C29C28179.7°179.9°
C14N30C29H31180.0°179.9°
N15C16C17C29179.5°180.0°
N15C16C17H400.1°0.0°
N15C16C17C18179.9°180.0°
N15C16C29C28179.9°180.0°
N15C16C29N300.6°0.2°
C16C17H40C18180.0°180.0°
C16C17C18H41179.3°180.0°
C16C17C18C190.7°0.0°
C17C16C29C280.4°0.0°
C17C16C29N30179.8°179.8°
C29C16C17H40179.6°180.0°
C29C16C17C180.4°0.0°
C16C29C28C190.5°0.0°
C16C29C28N30179.3°179.7°
C16C29C28H52179.5°180.0°
C16C29N30H31179.1°179.7°
H40C17C18H410.7°0.0°
H40C17C18C19179.3°180.0°
C17C18H41C19180.0°180.0°
C17C18C19C20178.3°180.0°
C17C18C19C280.9°0.0°
H41C18C19C201.7°0.0°
H41C18C19C28179.1°180.0°
C18C19C20C28177.4°179.9°
C18C19C20N21110.6°90.0°
C18C19C20H43129.4°29.9°
C18C19C20H425.1°150.0°
C18C19C28C290.8°0.0°
C18C19C28H52179.3°180.0°
C19C20N21H43120.0°120.0°
C19C20N21H42115.8°120.0°
C19C20H43H42116.3°120.0°
C19C20N21H2253.7°54.9°
C19C20N21C27172.2°65.0°
C19C20N21C2363.1°175.0°
C20C19C28C29178.2°180.0°
C20C19C28H521.9°0.1°
C28C19C20N2172.0°90.0°
C28C19C20H4348.0°150.0°
C28C19C20H42172.3°29.9°
C19C28C29H52180.0°180.0°
C19C28C29N30179.9°179.7°
N21C20H43H42116.3°120.0°
C20N21H22C27119.6°120.0°
C20N21H22C23121.1°120.1°
C20N21C27C23126.4°120.0°
C20N21C23C24174.6°180.0°
C20N21C23H4465.4°60.0°
C20N21C23H4556.0°60.0°
C20N21C27C26179.0°180.0°
C20N21C27H5161.1°60.0°
C20N21C27H5059.0°60.0°
H43C20N21H22173.7°174.9°
H43C20N21C2767.8°55.0°
H43C20N21C2356.9°65.0°
H42C20N21H2262.1°65.1°
H42C20N21C2756.5°175.0°
H42C20N21C23178.8°55.0°
H22N21C27C23117.1°120.0°
H22N21C23C2469.1°59.9°
H22N21C23H4450.8°60.0°
H22N21C23H45172.3°179.9°
H22N21C27C2662.4°60.0°
H22N21C27H51177.6°60.0°
H22N21C27H5057.5°180.0°
C27N21C23C2449.5°60.0°
C27N21C23H44169.5°180.0°
C27N21C23H4569.0°60.0°
N21C27C26O2560.3°57.6°
N21C27C26H4859.7°62.3°
N21C27C26H49179.1°177.5°
N21C27C26H51120.0°120.0°
N21C27C26H50120.0°119.9°
N21C27H51H50120.0°119.9°
N21C23C24H44120.0°120.0°
N21C23C24H45118.6°120.0°
N21C23H44H45118.7°120.0°
N21C23C24H4671.5°62.3°
N21C23C24O2548.6°57.6°
N21C23C24H47166.5°177.6°
C23N21C27C2654.6°60.0°
C23N21C27H5165.4°180.0°
C23N21C27H50174.6°60.0°
C24C23H44H45118.6°120.0°
C23C24H46O25123.8°119.8°
C23C24H46H47118.1°120.1°
C23C24O25H47118.0°119.9°
C23C24O25C2652.0°57.9°
H44C23C24H4648.6°57.6°
H44C23C24O25168.6°177.6°
H44C23C24H4773.5°62.4°
H45C23C24H46170.0°177.7°
H45C23C24O2570.0°62.3°
H45C23C24H4747.9°57.6°
H46C24O25H47122.0°120.1°
H46C24O25C2668.0°62.1°
C24O25C26H4861.8°62.0°
C24O25C26H49177.0°177.8°
C24O25C26C2758.2°57.9°
H47C24O25C26170.0°177.8°
O25C26H48H49118.8°120.1°
O25C26H48C27122.3°119.8°
O25C26H49C27121.5°119.8°
O25C26C27H5159.7°177.6°
O25C26C27H50179.7°62.3°
H48C26H49C27119.2°120.1°
H48C26C27H51179.7°57.7°
H48C26C27H5060.3°177.8°
H49C26C27H5159.1°62.5°
H49C26C27H5061.0°57.7°
C26C27H51H50120.0°120.1°
C28C29N30H310.3°0.0°
H52C28C29N300.2°0.2°

223532

PDB entries from 2024-08-07

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