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RO2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C3doub1.39Å1.41ÅAromatic
C1C5sing1.38Å1.39ÅAromatic
C1H1sing1.08Å1.10Å
C3O3sing1.36Å1.36Å
C3C4sing1.38Å1.40ÅAromatic
O3HO3sing0.97Å0.95Å
C4C2doub1.39Å1.37ÅAromatic
C4H4sing1.08Å1.10Å
C2C6sing1.40Å1.41ÅAromatic
C2C7sing1.48Å1.39ÅAromatic
C6C5doub1.38Å1.41ÅAromatic
C6H6sing1.08Å1.10Å
C5H5sing1.08Å1.10Å
C7N1sing1.37Å1.38ÅAromatic
C7N2doub1.31Å1.34ÅAromatic
N1C8sing1.38Å1.40ÅAromatic
N1HN1sing0.97Å1.02Å
C8C9doub1.41Å1.39ÅAromatic
C8C13sing1.38Å1.41ÅAromatic
C9N2sing1.35Å1.35ÅAromatic
C9C10sing1.40Å1.40ÅAromatic
C10C11doub1.36Å1.40ÅAromatic
C10H10sing1.08Å1.10Å
C11C12sing1.40Å1.39ÅAromatic
C11H11sing1.08Å1.10Å
C12C13doub1.39Å1.37ÅAromatic
C12C14sing1.48Å1.38ÅAromatic
C13H13sing1.08Å1.10Å
C14N3doub1.31Å1.38ÅAromatic
C14N4sing1.37Å1.32ÅAromatic
N3C15sing1.35Å1.42ÅAromatic
C15C16sing1.41Å1.38ÅAromatic
C15N7doub1.33Å1.41ÅAromatic
C16N4sing1.38Å1.33ÅAromatic
C16C17doub1.39Å1.41ÅAromatic
N4HN4sing0.97Å1.02Å
C17C18sing1.38Å1.40ÅAromatic
C17H17sing1.08Å1.10Å
C18C19doub1.39Å1.40ÅAromatic
C18H18sing1.08Å1.10Å
C19N7sing1.32Å1.35ÅAromatic
C19N5sing1.39Å1.38Å
N5C21sing1.47Å1.46Å
N5C24sing1.47Å1.48Å
C21C22sing1.53Å1.51Å
C21H211sing1.09Å1.12Å
C21H212sing1.09Å1.11Å
C22N6sing1.47Å1.44Å
C22H221sing1.09Å1.11Å
C22H222sing1.09Å1.11Å
N6C23sing1.47Å1.47Å
N6C25sing1.47Å1.46Å
C23C24sing1.53Å1.58Å
C23H231sing1.09Å1.12Å
C23H232sing1.09Å1.12Å
C24H241sing1.09Å1.11Å
C24H242sing1.09Å1.12Å
C25H253sing1.09Å1.12Å
C25H252sing1.09Å1.12Å
C25H251sing1.09Å1.11Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C3C1C5117.2°120.2°
C3C1H1121.9°119.9°
C1C3O3117.4°119.9°
C1C3C4124.4°120.0°
C5C1H1120.9°119.9°
C1C5C6119.5°120.2°
C1C5H5119.5°119.9°
O3C3C4118.1°120.0°
C3O3HO3117.4°106.8°
C3C4C2117.1°119.8°
C3C4H4122.4°120.1°
C2C4H4120.5°120.1°
C4C2C6120.6°119.7°
C4C2C7117.4°120.1°
C6C2C7121.9°120.1°
C2C6C5121.0°120.0°
C2C6H6119.4°120.0°
C2C7N1120.9°125.2°
C2C7N2131.8°125.1°
C5C6H6119.6°120.0°
C6C5H5121.0°119.9°
N1C7N2107.2°109.8°
C7N1C8108.8°107.1°
C7N1HN1124.9°126.4°
C7N2C9110.2°109.8°
C8N1HN1126.3°126.4°
N1C8C9104.9°106.1°
N1C8C13132.9°133.9°
C9C8C13122.2°120.0°
C8C9N2108.8°107.2°
C8C9C10121.3°119.6°
C8C13C12116.7°119.6°
C8C13H13122.9°120.3°
N2C9C10129.9°133.2°
C9C10C11115.4°120.1°
C9C10H10122.3°119.9°
C11C10H10122.2°120.0°
C10C11C12123.0°120.5°
C10C11H11119.0°119.7°
C12C11H11118.0°119.8°
C11C12C13121.3°120.2°
C11C12C14115.9°119.9°
C13C12C14122.8°120.0°
C12C13H13120.4°120.2°
C12C14N3125.7°125.1°
C12C14N4130.1°125.2°
N3C14N4104.2°109.7°
C14N3C15110.0°109.9°
C14N4C16114.1°107.0°
C14N4HN4122.6°126.5°
N3C15C16103.8°107.1°
N3C15N7137.0°133.0°
C16C15N7119.3°119.9°
C15C16N4107.9°106.4°
C15C16C17123.7°119.6°
C15N7C19117.9°121.5°
N4C16C17128.4°134.1°
C16N4HN4123.3°126.5°
C16C17C18115.2°118.4°
C16C17H17122.6°120.8°
C18C17H17122.3°120.8°
C17C18C19120.8°119.4°
C17C18H18119.8°120.3°
C19C18H18119.4°120.3°
C18C19N7123.1°121.2°
C18C19N5118.1°119.4°
N7C19N5118.8°119.4°
C19N5C21122.0°106.7°
C19N5C24119.1°106.7°
C21N5C24113.0°106.9°
N5C21C22114.1°109.7°
N5C21H211110.5°109.4°
N5C21H212110.5°109.4°
N5C24C23117.0°109.6°
N5C24H241109.5°109.5°
N5C24H242109.5°109.5°
C22C21H211110.5°109.5°
C22C21H212110.5°109.4°
C21C22N6108.9°109.7°
C21C22H221112.4°109.4°
C21C22H222112.4°109.4°
H211C21H21299.7°109.4°
N6C22H221112.4°109.4°
N6C22H222112.4°109.5°
C22N6C23116.5°106.9°
C22N6C25110.4°106.7°
H221C22H22298.0°109.4°
C23N6C25111.8°106.7°
N6C23C24116.9°109.7°
N6C23H231109.5°109.4°
N6C23H232109.6°109.5°
N6C25H253110.4°109.4°
N6C25H252111.9°109.5°
N6C25H251111.9°109.4°
C24C23H231109.5°109.4°
C24C23H232109.5°109.5°
C23C24H241109.4°109.4°
C23C24H242109.4°109.4°
H231C23H232100.5°109.4°
H241C24H242100.7°109.4°
H253C25H252111.8°109.5°
H253C25H251111.9°109.5°
H252C25H25198.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C3C1C5H1180.0°179.8°
C1C3O3C4179.2°179.8°
C1C3O3HO3180.0°90.1°
C1C3C4C23.2°0.5°
C1C3C4H4176.8°180.0°
C3C1C5C61.5°0.1°
C3C1C5H5178.5°180.0°
C5C1C3O3179.0°179.9°
C5C1C3C40.1°0.2°
C1C5C6C20.1°0.0°
C1C5C6H5179.9°179.9°
C1C5C6H6179.9°179.9°
H1C1C3O31.0°0.1°
H1C1C3C4179.9°179.7°
H1C1C5C6178.5°179.9°
H1C1C5H51.5°0.2°
O3C3C4C2175.9°179.7°
O3C3C4H44.1°0.2°
C4C3O3HO30.9°89.7°
C3C4C2H4180.0°179.5°
C3C4C2C64.7°0.5°
C3C4C2C7173.0°179.8°
C4C2C6C7177.6°179.7°
C4C2C6C53.3°0.3°
C4C2C6H6176.6°179.8°
C4C2C7N136.0°140.0°
C4C2C7N2147.1°40.0°
H4C4C2C6175.3°179.9°
H4C4C2C77.0°0.2°
C2C6C5H6180.0°179.9°
C2C6C5H5180.0°179.9°
C6C2C7N1146.3°39.7°
C6C2C7N230.6°140.3°
C7C2C6C5174.3°180.0°
C7C2C6H65.8°0.1°
C2C7N1N2177.6°180.0°
C2C7N1C8174.8°180.0°
C2C7N1HN15.1°0.0°
C2C7N2C9174.8°180.0°
H6C6C5H50.0°0.0°
C7N1C8HN1179.9°180.0°
C7N1C8C92.0°0.0°
C7N1C8C13178.0°179.6°
N1C7N2C92.4°0.1°
N2C7N1C82.8°0.0°
N2C7N1HN1177.3°179.9°
C7N2C9C81.2°0.1°
C7N2C9C10178.2°180.0°
N1C8C9C13180.0°179.7°
N1C8C9N20.5°0.0°
N1C8C9C10180.0°180.0°
N1C8C13C12178.8°179.8°
N1C8C13H131.2°0.1°
HN1N1C8C9178.1°180.0°
HN1N1C8C132.0°0.3°
C8C9N2C10179.4°179.9°
C8C9C10C110.4°0.1°
C8C9C10H10179.6°180.0°
C9C8C13C121.2°0.6°
C9C8C13H13178.8°179.7°
C13C8C9N2179.5°179.7°
C13C8C9C100.0°0.3°
C8C13C12C112.0°0.7°
C8C13C12H13180.0°179.7°
C8C13C12C14176.8°179.7°
N2C9C10C11179.7°180.0°
N2C9C10H100.2°0.1°
C9C10C11H10180.0°179.9°
C9C10C11C120.5°0.0°
C9C10C11H11179.5°179.9°
C10C11C12H11180.0°179.9°
C10C11C12C131.7°0.3°
C10C11C12C14177.2°180.0°
H10C10C11C12179.6°180.0°
H10C10C11H110.4°0.0°
C11C12C13C14178.8°179.7°
C11C12C13H13178.0°179.7°
C11C12C14N3172.8°140.0°
C11C12C14N45.3°40.0°
H11C11C12C13178.2°179.7°
H11C11C12C142.9°0.1°
C13C12C14N38.4°39.6°
C13C12C14N4173.6°140.3°
C14C12C13H133.2°0.0°
C12C14N3N4178.4°180.0°
C12C14N3C15176.7°179.9°
C12C14N4C16177.0°180.0°
C12C14N4HN42.9°0.1°
C14N3C15C161.6°0.1°
C14N3C15N7178.5°179.7°
N3C14N4C161.3°0.0°
N3C14N4HN4178.7°179.9°
N4C14N3C151.8°0.0°
C14N4C16C150.4°0.1°
C14N4C16HN4179.9°179.9°
C14N4C16C17179.6°180.0°
N3C15C16N7180.0°179.7°
N3C15C16N40.8°0.1°
N3C15C16C17178.6°180.0°
N3C15N7C19177.6°179.9°
C15C16N4C17179.3°179.9°
C15C16N4HN4179.7°180.0°
C15C16C17C180.2°0.0°
C15C16C17H17179.9°179.9°
C16C15N7C192.3°0.5°
N7C15C16N4179.3°179.8°
N7C15C16C171.4°0.3°
C15N7C19C182.1°0.5°
C15N7C19N5177.7°179.7°
N4C16C17C18179.3°179.9°
N4C16C17H170.7°0.0°
C17C16N4HN40.4°0.1°
C16C17C18H17180.0°179.9°
C16C17C18C190.1°0.1°
C16C17C18H18179.9°180.0°
C17C18C19H18180.0°180.0°
C17C18C19N70.9°0.2°
C17C18C19N5178.9°179.9°
H17C17C18C19179.8°180.0°
H17C17C18H180.1°0.1°
C18C19N7N5179.8°179.8°
C18C19N5C2117.9°180.0°
C18C19N5C24133.1°66.0°
H18C18C19N7179.0°179.8°
H18C18C19N51.1°0.0°
N7C19N5C21161.9°0.2°
N7C19N5C2447.1°114.2°
C19N5C21C24152.6°113.9°
C19N5C21C22165.8°175.1°
C19N5C21H21168.9°64.8°
C19N5C21H21240.5°55.0°
C19N5C24C23148.9°175.1°
C19N5C24H24185.8°64.9°
C19N5C24H24223.7°55.0°
N5C21C22H211125.2°120.1°
N5C21C22H212125.3°120.1°
N5C21H211H212116.3°119.9°
N5C21C22N667.4°62.9°
N5C21C22H221167.3°57.1°
N5C21C22H22257.8°177.0°
C21N5C24C234.6°61.2°
C21N5C24H241120.7°178.8°
C21N5C24H242129.8°58.8°
C24N5C21C2241.6°61.2°
C24N5C21H21183.7°178.7°
C24N5C21H212166.9°58.9°
N5C24C23N627.4°63.0°
N5C24C23H241125.3°120.0°
N5C24C23H242125.3°120.0°
N5C24C23H23197.9°177.0°
N5C24C23H232152.7°57.2°
N5C24H241H242115.3°120.0°
C22C21H211H212116.4°119.9°
C21C22N6H221125.3°120.1°
C21C22N6H222125.3°120.1°
C21C22H221H222118.4°119.9°
C21C22N6C2341.8°61.2°
C21C22N6C2587.1°175.1°
H211C21C22N657.8°177.0°
H211C21C22H22167.4°62.9°
H211C21C22H222176.9°56.9°
H212C21C22N6167.3°57.1°
H212C21C22H22142.0°177.2°
H212C21C22H22267.5°63.0°
N6C22H221H222118.3°119.9°
C22N6C23C25128.2°113.9°
C22N6C23C241.9°61.2°
C22N6C23H231123.4°178.7°
C22N6C23H232127.2°58.9°
C22N6C25H253180.0°60.1°
C22N6C25H25254.7°60.0°
C22N6C25H25154.7°180.0°
H221C22N6C23167.0°58.9°
H221C22N6C2538.2°55.0°
H222C22N6C2383.5°178.7°
H222C22N6C25147.6°64.9°
N6C23C24H231125.3°120.0°
N6C23C24H232125.3°120.1°
N6C23H231H232115.3°119.9°
N6C23C24H24197.9°177.0°
N6C23C24H242152.7°57.1°
C23N6C25H25348.6°53.9°
C23N6C25H25276.6°174.0°
C23N6C25H251173.9°66.0°
C25N6C23C24130.0°175.1°
C25N6C23H2314.7°64.8°
C25N6C23H232104.7°55.0°
N6C25H253H252125.3°120.0°
N6C25H253H251125.3°119.9°
N6C25H252H251117.8°120.0°
C24C23H231H232115.3°119.9°
C23C24H241H242115.2°119.9°
H231C23C24H241136.8°57.0°
H231C23C24H24227.4°62.9°
H232C23C24H24127.4°62.9°
H232C23C24H24282.0°177.2°
H253C25H252H251117.8°120.0°

248636

PDB entries from 2026-02-04

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