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SummaryGeometryRelated PDB entries

IQV

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C12C13doub1.34Å1.35Å
C13C14sing1.47Å1.49Å
C14N15sing1.36Å1.36ÅAromatic
C14N18doub1.32Å1.35ÅAromatic
N15N16sing1.40Å1.37ÅAromatic
N15C19sing1.46Å1.45Å
N16C17doub1.32Å1.35ÅAromatic
C17N18sing1.34Å1.35ÅAromatic
C17C20sing1.49Å1.48Å
C20C21doub1.37Å1.36ÅAromatic
C20C24sing1.41Å1.36ÅAromatic
C21N22sing1.35Å1.34ÅAromatic
N22N23sing1.40Å1.39ÅAromatic
N23C24doub1.31Å1.35ÅAromatic
C02H1sing1.08Å1.08Å
C10H17sing1.09Å1.10Å
C10H26sing1.09Å1.10Å
C10H28sing1.09Å1.10Å
C11H18sing1.09Å1.10Å
C11H30sing1.09Å1.10Å
C11H31sing1.09Å1.10Å
C13H33sing1.08Å1.08Å
C19H34sing1.09Å1.10Å
C19H35sing1.09Å1.10Å
C19H36sing1.09Å1.10Å
C21H37sing1.08Å1.08Å
C24H39sing1.08Å1.08Å
C12H53sing1.08Å1.08Å
N22H38sing0.97Å1.00Å
C12C08sing1.47Å1.46Å
C08N09sing1.33Å1.37ÅAromatic
C08N07doub1.33Å1.35ÅAromatic
N07N06sing1.40Å1.36ÅAromatic
N09C05doub1.32Å1.37ÅAromatic
C05C04sing1.41Å1.49ÅAromatic
C04N01doub1.31Å1.41ÅAromatic
N01C02sing1.33Å1.41ÅAromatic
C02C03doub1.35Å1.48ÅAromatic
C03N06sing1.36Å1.44ÅAromatic
N06C05sing1.37Å1.37ÅAromatic
C04C10sing1.51Å1.50Å
C03C11sing1.51Å1.52Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C12C13C14116.9°120.0°
C12C13H33121.5°120.0°
C13C12H53120.0°120.0°
C13C12C08120.0°120.0°
C13C14N15127.4°126.1°
C13C14N18123.4°126.1°
C14C13H33121.5°120.0°
N15C14N18109.2°107.8°
C14N15N16106.7°106.3°
C14N15C19127.0°126.8°
C14N18C17107.3°109.7°
N16N15C19126.3°126.9°
N15N16C17108.0°107.0°
N15C19H34109.5°109.4°
N15C19H35109.4°109.4°
N15C19H36109.5°109.5°
N16C17N18108.8°109.2°
N16C17C20127.0°125.4°
N18C17C20124.2°125.5°
C17C20C21125.0°126.2°
C17C20C24126.4°126.3°
C21C20C24108.5°107.5°
C20C21N22107.6°107.6°
C20C21H37126.2°126.2°
C20C24N23108.3°108.1°
C20C24H39125.8°125.9°
C21N22N23108.8°108.2°
N22C21H37126.2°126.2°
C21N22H38125.6°125.9°
N22N23C24106.8°108.5°
N23N22H38125.6°125.9°
N23C24H39125.8°126.0°
H1C02N01119.9°119.4°
H1C02C03120.0°119.4°
H17C10H26109.5°109.6°
H17C10H28109.4°109.5°
H17C10C04109.5°109.5°
H26C10H28109.4°109.4°
H26C10C04109.5°109.5°
H28C10C04109.5°109.4°
H18C11H30109.5°109.5°
H18C11H31109.5°109.5°
H18C11C03109.5°109.5°
H30C11H31109.5°109.4°
H30C11C03109.4°109.5°
H31C11C03109.5°109.5°
H34C19H35109.5°109.5°
H34C19H36109.5°109.5°
H35C19H36109.5°109.5°
H53C12C08120.0°120.0°
C12C08N09128.6°125.4°
C12C08N07121.8°125.3°
N09C08N07109.5°109.3°
C08N09C05105.5°109.7°
C08N07N06108.3°106.9°
N07N06C03129.7°134.2°
N07N06C05106.7°106.4°
N09C05C04130.3°133.6°
N09C05N06110.0°107.6°
C05C04N01117.9°119.6°
C04C05N06119.7°118.8°
C05C04C10119.8°120.2°
C04N01C02122.4°121.3°
N01C04C10122.3°120.2°
N01C02C03120.1°121.2°
C02C03N06116.2°119.7°
C02C03C11122.5°120.1°
C03N06C05123.6°119.4°
N06C03C11121.2°120.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C12C13C14H33180.0°179.9°
C12C13C14N1561.3°180.0°
C12C13C14N18117.1°0.4°
C13C12H53C08180.0°180.0°
C13C12C08N0918.5°0.0°
C13C12C08N07162.9°179.9°
C13C14N15N18178.6°179.7°
C13C14N15N16179.2°179.9°
C13C14N15C191.8°0.1°
C13C14N18C17179.0°179.9°
C14C13C12H537.5°0.1°
C14C13C12C08172.5°180.0°
C14N15N16C19179.0°179.9°
C14N15N16C170.7°0.2°
N15C14N18C170.3°0.4°
N15C14C13H33118.6°0.1°
C14N15C19H34178.8°90.1°
C14N15C19H3561.2°150.0°
C14N15C19H3658.7°30.0°
N18C14N15N160.6°0.4°
N18C14N15C19179.6°179.5°
C14N18C17N160.2°0.2°
C14N18C17C20177.9°180.0°
N18C14C13H3362.9°179.5°
N15N16C17N180.5°0.0°
N15N16C17C20178.2°179.7°
N16N15C19H340.0°90.0°
N16N15C19H35120.0°29.9°
N16N15C19H36120.0°149.9°
C19N15N16C17179.7°179.7°
N15C19H34H35120.0°119.9°
N15C19H34H36120.0°120.0°
N15C19H35H36120.0°120.0°
N16C17N18C20177.8°179.7°
N16C17C20C2121.8°179.7°
N16C17C20C24162.4°0.0°
N18C17C20C21155.6°0.1°
N18C17C20C2420.2°179.6°
C17C20C21C24176.5°179.8°
C17C20C21N22178.9°180.0°
C17C20C24N23179.1°180.0°
C17C20C21H371.1°0.0°
C17C20C24H390.9°0.0°
C20C21N22H37180.0°180.0°
C20C21N22N231.3°0.2°
C21C20C24N232.7°0.2°
C21C20C24H39177.3°179.7°
C20C21N22H38178.7°180.0°
C24C20C21N222.5°0.2°
C20C24N23N221.9°0.1°
C20C24N23H39180.0°179.9°
C24C20C21H37177.5°179.8°
C21N22N23H38180.0°179.8°
C21N22N23C240.4°0.0°
N23N22C21H37178.7°179.8°
N22N23C24H39178.1°179.8°
C24N23N22H38179.6°179.8°
H1C02N01C04179.7°180.0°
H1C02N01C03180.0°179.8°
H1C02C03N06178.9°180.0°
H1C02C03C110.4°0.0°
H17C10H26H28119.9°120.0°
H17C10H26C04120.1°120.0°
H17C10H28C04120.1°119.9°
H17C10C04C05178.5°180.0°
H17C10C04N010.0°0.0°
H26C10H28C04120.0°120.0°
H26C10C04C0558.4°59.9°
H26C10C04N01120.0°120.1°
H28C10C04C0561.5°60.0°
H28C10C04N01120.0°120.0°
H18C11H30H31120.0°120.0°
H18C11H30C03120.0°120.0°
H18C11H31C03120.0°120.1°
H18C11C03C0289.2°0.0°
H18C11C03N0689.2°180.0°
H30C11H31C03120.0°119.9°
H30C11C03C02150.8°120.0°
H30C11C03N0630.8°60.0°
H31C11C03C0230.8°120.0°
H31C11C03N06150.8°60.0°
H33C13C12H53172.5°180.0°
H33C13C12C087.5°0.0°
H34C19H35H36120.0°120.1°
H37C21N22H381.3°0.0°
H53C12C08N09161.5°180.0°
H53C12C08N0717.1°0.1°
C12C08N09N07178.7°179.9°
C12C08N07N06179.2°179.9°
C12C08N09C05179.5°179.9°
N09C08N07N060.4°0.0°
C08N09C05C04178.8°179.7°
C08N09C05N061.0°0.0°
N07C08N09C050.9°0.0°
C08N07N06C03178.6°179.9°
C08N07N06C050.2°0.0°
N07N06C05N090.8°0.0°
N07N06C05C04179.1°179.8°
N07N06C03C02179.4°180.0°
N07N06C03C05178.6°179.9°
N07N06C03C110.8°0.0°
N09C05C04N06179.8°179.7°
N09C05C04N01179.1°180.0°
N09C05N06C03178.1°179.9°
N09C05C04C100.5°0.0°
C05C04N01C10178.5°180.0°
C05C04N01C020.3°0.0°
C04C05N06C032.0°0.3°
C04N01C02C030.4°0.2°
N01C04C05N061.1°0.3°
N01C02C03N061.1°0.2°
C02N01C04C10178.8°180.0°
N01C02C03C11179.6°179.8°
C02C03N06C11178.5°180.0°
C02C03N06C052.0°0.0°
N06C05C04C10179.7°179.7°
C05N06C03C11179.5°180.0°

226262

PDB entries from 2024-10-16

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