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BDY

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1C2sing1.39Å1.40Å
N3C4doub1.32Å1.33ÅAromatic
N3C2sing1.32Å1.34ÅAromatic
C4C5sing1.39Å1.37ÅAromatic
C5N6doub1.33Å1.34ÅAromatic
C5C18sing1.48Å1.45ÅAromatic
C7C2doub1.40Å1.39ÅAromatic
C7N6sing1.32Å1.34ÅAromatic
C7N8sing1.39Å1.42Å
C10C9sing1.51Å1.51Å
C10C11doub1.38Å1.39ÅAromatic
C10C16sing1.38Å1.38ÅAromatic
C13C11sing1.38Å1.38ÅAromatic
C13C14doub1.38Å1.37ÅAromatic
C15C14sing1.38Å1.38ÅAromatic
C15C16doub1.38Å1.38ÅAromatic
C20C21doub1.40Å1.38ÅAromatic
C20C19sing1.38Å1.38ÅAromatic
C21C22sing1.40Å1.38ÅAromatic
C21C24sing1.48Å1.48Å
C22C23doub1.38Å1.38ÅAromatic
C24O25doub1.22Å1.22Å
C24N26sing1.35Å1.40Å
C28C27sing1.55Å1.51Å
C28C29sing1.55Å1.50Å
N8C9sing1.46Å1.47Å
C11CL12sing1.74Å1.72Å
C16CL17sing1.74Å1.72Å
C18C19doub1.40Å1.38ÅAromatic
C18C23sing1.40Å1.38ÅAromatic
N26C27sing1.47Å1.45Å
N26C30sing1.47Å1.45Å
C29C30sing1.54Å1.51Å
C30C31sing1.53Å1.52Å
C31N32sing1.47Å1.46Å
N32C33sing1.47Å1.46Å
N32C36sing1.48Å1.46Å
C33C34sing1.54Å1.51Å
C34C35sing1.55Å1.51Å
C35C36sing1.55Å1.51Å
N1HN1sing0.97Å1.00Å
N1HN1Asing0.97Å1.00Å
C4H4sing1.08Å1.08Å
C13H13sing1.08Å1.08Å
C15H15sing1.08Å1.08Å
C20H20sing1.08Å1.08Å
C22H22sing1.08Å1.08Å
C28H28sing1.09Å1.10Å
C28H28Asing1.09Å1.10Å
N8HN8sing0.97Å1.00Å
C9H9sing1.09Å1.10Å
C9H9Asing1.09Å1.10Å
C14H14sing1.08Å1.08Å
C19H19sing1.08Å1.08Å
C23H23sing1.08Å1.08Å
C27H27sing1.09Å1.10Å
C27H27Asing1.09Å1.10Å
C29H29sing1.09Å1.10Å
C29H29Asing1.09Å1.10Å
C30H30sing1.09Å1.10Å
C31H31sing1.09Å1.10Å
C31H31Asing1.09Å1.10Å
C33H33sing1.09Å1.10Å
C33H33Asing1.09Å1.10Å
C34H34sing1.09Å1.10Å
C34H34Asing1.09Å1.10Å
C35H35sing1.09Å1.10Å
C35H35Asing1.09Å1.10Å
C36H36sing1.09Å1.10Å
C36H36Asing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N1C2N3117.8°120.1°
N1C2C7118.9°120.0°
C2N1HN1109.5°120.0°
C2N1HN1A109.5°120.0°
C4N3C2114.9°120.2°
N3C4C5123.0°120.1°
N3C4H4118.5°120.0°
N3C2C7123.4°119.9°
C4C5N6121.5°120.1°
C4C5C18121.8°119.9°
C5C4H4118.5°120.0°
N6C5C18116.7°120.0°
C5N6C7117.0°119.9°
C5C18C19120.1°120.0°
C5C18C23121.3°120.0°
C2C7N6120.2°119.8°
C2C7N8118.1°120.1°
N6C7N8121.8°120.1°
C7N8C9117.0°120.0°
C7N8HN8107.0°120.1°
C9C10C11120.1°120.0°
C9C10C16123.3°120.0°
C10C9N8113.6°109.5°
C10C9H9108.1°109.5°
C10C9H9A108.1°109.4°
C11C10C16116.6°120.0°
C10C11C13122.6°120.0°
C10C11CL12120.8°120.0°
C10C16C15121.1°120.0°
C10C16CL17122.4°120.0°
C11C13C14119.7°120.0°
C13C11CL12116.5°119.9°
C11C13H13120.1°120.1°
C13C14C15118.7°120.0°
C14C13H13120.2°119.9°
C13C14H14120.6°120.0°
C14C15C16121.2°120.0°
C14C15H15119.4°120.0°
C15C14H14120.7°120.0°
C15C16CL17116.5°120.0°
C16C15H15119.4°120.0°
C21C20C19119.9°120.0°
C20C21C22119.8°119.9°
C20C21C24117.6°120.0°
C21C20H20120.1°120.0°
C20C19C18121.0°120.0°
C19C20H20120.1°120.0°
C20C19H19119.5°120.0°
C22C21C24122.6°120.1°
C21C22C23120.0°120.0°
C21C22H22120.0°120.0°
C21C24O25115.3°120.0°
C21C24N26120.4°120.0°
C22C23C18120.8°120.0°
C23C22H22120.0°120.0°
C22C23H23119.6°120.0°
O25C24N26124.3°120.0°
C24N26C27122.4°125.7°
C24N26C30117.9°125.7°
C27C28C29106.7°101.6°
C28C27N26108.0°104.8°
C27C28H28110.4°110.9°
C27C28H28A110.4°111.0°
C28C27H27110.0°110.4°
C28C27H27A109.9°110.4°
C28C29C30106.6°103.0°
C29C28H28110.4°111.0°
C29C28H28A110.4°111.0°
C28C29H29110.4°110.7°
C28C29H29A110.4°110.7°
C9N8HN8107.0°120.0°
N8C9H9108.1°109.5°
N8C9H9A108.1°109.5°
C19C18C23118.6°120.0°
C18C19H19119.5°120.0°
C18C23H23119.6°120.0°
C27N26C30110.2°108.7°
N26C27H27110.0°110.3°
N26C27H27A110.0°110.4°
N26C30C29107.7°107.2°
N26C30C31114.6°109.9°
N26C30H30107.0°109.8°
C29C30C31108.8°109.9°
C30C29H29110.4°110.7°
C30C29H29A110.4°110.7°
C29C30H30113.0°109.9°
C30C31N32112.6°109.5°
C31C30H30105.9°110.0°
C30C31H31108.5°109.5°
C30C31H31A108.4°109.4°
C31N32C33106.6°111.0°
C31N32C36109.2°111.0°
N32C31H31108.4°109.5°
N32C31H31A108.5°109.5°
C33N32C36107.8°108.6°
N32C33C34108.0°107.2°
N32C33H33110.0°109.9°
N32C33H33A109.9°109.9°
N32C36C35108.4°104.8°
N32C36H36109.9°110.4°
N32C36H36A109.8°110.4°
C33C34C35106.5°103.0°
C34C33H33109.9°109.9°
C34C33H33A109.9°109.9°
C33C34H34110.5°110.7°
C33C34H34A110.4°110.6°
C34C35C36106.4°101.7°
C35C34H34110.5°110.7°
C35C34H34A110.5°110.7°
C34C35H35110.5°111.0°
C34C35H35A110.5°111.0°
C36C35H35110.5°111.0°
C36C35H35A110.5°111.0°
C35C36H36109.8°110.4°
C35C36H36A109.9°110.4°
HN1N1HN1A109.5°120.0°
H28C28H28A108.5°110.9°
H9C9H9A110.8°109.5°
H27C27H27A109.0°110.4°
H29C29H29A108.5°110.8°
H31C31H31A110.4°109.4°
H33C33H33A109.0°110.0°
H34C34H34A108.5°110.8°
H35C35H35A108.4°110.9°
H36C36H36A109.1°110.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N1C2N3C4179.5°180.0°
N1C2N3C7180.0°180.0°
N1C2C7N6179.3°179.9°
N1C2C7N80.0°0.0°
C2N1HN1HN1A120.0°179.8°
N3C4C5H4180.0°180.0°
N3C4C5N60.9°0.0°
N3C4C5C18178.7°180.0°
C4N3C2C70.4°0.0°
C2N3C4C50.3°0.0°
N3C2C7N60.6°0.0°
N3C2C7N8180.0°179.9°
N3C2N1HN10.0°0.1°
N3C2N1HN1A120.0°179.7°
C2N3C4H4179.7°180.0°
C4C5N6C18179.6°180.0°
C4C5N6C70.6°0.1°
C4C5C18C19150.0°5.0°
C4C5C18C2330.0°175.0°
C5N6C7C20.1°0.1°
C5N6C7N8179.4°180.0°
N6C5C18C1929.6°175.0°
N6C5C18C23150.4°4.9°
N6C5C4H4179.1°180.0°
C18C5N6C7179.0°180.0°
C5C18C19C20179.8°179.9°
C5C18C23C22180.0°180.0°
C5C18C19C23180.0°179.9°
C18C5C4H41.3°0.1°
C5C18C19H190.2°0.1°
C5C18C23H230.0°0.1°
C2C7N6N8179.3°179.9°
C2C7N8C9176.3°180.0°
C7C2N1HN1180.0°179.9°
C7C2N1HN1A60.0°0.2°
C2C7N8HN863.8°0.0°
N6C7N8C94.4°0.1°
N6C7N8HN8115.6°179.9°
C7N8C9C1085.4°180.0°
C7N8C9HN8120.0°179.9°
C7N8C9H934.6°60.0°
C7N8C9H9A154.6°60.1°
C9C10C11C16179.2°179.7°
C9C10C11C13179.5°180.0°
C9C10C16C15179.8°180.0°
C10C9N8H9120.0°120.0°
C10C9N8H9A120.0°119.9°
C9C10C11CL120.2°0.0°
C9C10C16CL170.0°0.0°
C10C9N8HN834.6°0.1°
C10C9H9H9A118.3°119.9°
C10C11C13CL12179.3°180.0°
C10C11C13C140.3°0.1°
C11C10C16C150.6°0.3°
C11C10C9N8131.1°89.9°
C11C10C16CL17179.2°179.7°
C10C11C13H13179.7°180.0°
C11C10C9H911.1°150.0°
C11C10C9H9A108.9°30.0°
C16C10C11C130.2°0.3°
C10C16C15C140.5°0.0°
C10C16C15CL17179.8°180.0°
C16C10C9N849.8°90.3°
C16C10C11CL12179.0°179.7°
C10C16C15H15179.6°179.7°
C16C10C9H9169.8°29.7°
C16C10C9H9A70.2°149.7°
C11C13C14H13180.0°180.0°
C11C13C14C150.5°0.3°
C11C13C14H14179.5°180.0°
C13C14C15H14180.0°179.7°
C13C14C15C160.1°0.3°
C14C13C11CL12179.6°180.0°
C13C14C15H15179.8°180.0°
C14C15C16H15180.0°179.7°
C14C15C16CL17179.4°180.0°
C15C14C13H13179.5°179.7°
C16C15C14H14179.9°180.0°
C21C20C19H20180.0°179.8°
C20C21C22C24179.1°179.9°
C20C21C22C230.6°0.1°
C20C21C24O2532.5°10.0°
C20C21C24N26147.4°170.1°
C21C20C19C180.1°0.0°
C20C21C22H22179.4°180.0°
C21C20C19H19179.9°180.0°
C19C20C21C220.3°0.0°
C19C20C21C24179.4°179.9°
C20C19C18H19180.0°180.0°
C20C19C18C230.2°0.0°
C21C22C23H22180.0°179.9°
C22C21C24O25146.5°170.1°
C22C21C24N2633.5°9.8°
C21C22C23C180.4°0.1°
C22C21C20H20179.7°179.8°
C21C22C23H23179.6°180.0°
C24C21C22C23179.6°180.0°
C21C24O25N26180.0°179.9°
C21C24N26C2725.5°6.8°
C21C24N26C30168.5°173.2°
C24C21C20H200.6°0.3°
C24C21C22H220.3°0.1°
C22C23C18C190.1°0.0°
C22C23C18H23180.0°180.0°
O25C24N26C27154.5°173.2°
O25C24N26C3011.5°6.8°
C24N26C27C28139.9°155.8°
C24N26C27C30145.5°180.0°
C24N26C30C29138.3°178.9°
C24N26C30C31100.6°61.7°
C24N26C27H2719.9°37.0°
C24N26C27H27A100.1°85.3°
C24N26C30H3016.5°59.5°
C27C28C29H28120.0°118.0°
C27C28C29H28A120.0°118.1°
C28C27N26H27120.0°118.8°
C28C27N26H27A120.0°118.9°
C28C27N26C305.5°24.2°
C27C28C29C305.3°35.5°
C27C28H28H28A121.1°123.9°
C28C27H27H27A120.6°122.4°
C27C28C29H29125.3°82.8°
C27C28C29H29A114.7°153.9°
C29C28C27N260.1°37.1°
C28C29C30N268.7°22.2°
C28C29C30H29120.0°118.4°
C28C29C30H29A120.0°118.4°
C28C29C30C31116.0°141.6°
C29C28H28H28A121.1°123.9°
C29C28C27H27119.9°155.8°
C29C28C27H27A120.1°81.8°
C28C29H29H29A121.2°123.3°
C28C29C30H30126.7°97.2°
N8C9H9H9A118.3°120.0°
CL12C11C13H130.4°0.0°
CL17C16C15H150.6°0.3°
C18C19C20H20179.9°179.7°
C19C18C23H23180.0°180.0°
C18C23C22H22179.5°180.0°
C23C18C19H19179.8°180.0°
C27N26C30C298.9°1.1°
C27N26C30C31112.2°118.3°
N26C27C28H28119.9°155.1°
N26C27C28H28A120.1°81.0°
N26C27H27H27A120.6°122.3°
C27N26C30H30130.7°120.5°
N26C30C29C31124.7°119.4°
N26C30C29H30118.0°119.4°
N26C30C31H30117.7°121.1°
N26C30C31N3248.6°62.2°
C30N26C27H27125.5°143.0°
C30N26C27H27A114.5°94.7°
N26C30C29H29128.7°96.2°
N26C30C29H29A111.3°140.6°
N26C30C31H3171.4°57.9°
N26C30C31H31A168.6°177.9°
C29C30C31H30121.8°121.2°
C29C30C31N32169.2°179.9°
C30C29C28H28114.6°153.5°
C30C29C28H28A125.3°82.6°
C30C29H29H29A121.2°123.2°
C29C30C31H3149.2°59.9°
C29C30C31H31A70.8°60.1°
C30C31N32H31120.0°120.1°
C30C31N32H31A120.0°120.0°
C30C31N32C33155.6°163.6°
C30C31N32C3688.1°75.5°
C31C30C29H293.9°23.2°
C31C30C29H29A123.9°100.0°
C30C31H31H31A118.7°119.9°
C31N32C33C36117.2°122.3°
C31N32C33C34134.2°123.3°
C31N32C36C35131.5°146.4°
N32C31C30H3069.1°58.9°
N32C31H31H31A118.7°120.0°
C31N32C33H33105.8°117.3°
C31N32C33H33A14.2°3.9°
C31N32C36H3611.4°27.6°
C31N32C36H36A108.5°94.8°
N32C33C34H33120.0°119.4°
N32C33C34H33A120.0°119.4°
N32C33C34C3511.4°22.3°
C33N32C36C3516.0°24.1°
C33N32C31H3135.6°43.5°
C33N32C31H31A84.3°76.5°
N32C33H33H33A120.6°121.1°
N32C33C34H34108.6°140.7°
N32C33C34H34A131.4°96.1°
C33N32C36H36104.0°94.7°
C33N32C36H36A136.0°142.9°
C36N32C33C3417.0°1.0°
N32C36C35C348.7°37.1°
N32C36C35H36120.0°118.8°
N32C36C35H36A120.0°118.9°
C36N32C31H31151.8°164.4°
C36N32C31H31A31.9°44.4°
C36N32C33H33137.0°120.4°
C36N32C33H33A102.9°118.4°
N32C36C35H35111.3°81.0°
N32C36C35H35A128.7°155.1°
N32C36H36H36A120.4°122.3°
C33C34C35H34120.0°118.4°
C33C34C35H34A120.0°118.3°
C33C34C35C361.6°35.6°
C34C33H33H33A120.6°121.1°
C33C34H34H34A121.2°123.1°
C33C34C35H35121.7°82.5°
C33C34C35H35A118.4°153.7°
C34C35C36H35120.0°118.1°
C34C35C36H35A120.0°118.1°
C35C34C33H33131.4°97.1°
C35C34C33H33A108.6°141.7°
C35C34H34H34A121.2°123.3°
C34C35H35H35A121.2°123.9°
C34C35C36H36111.3°81.7°
C34C35C36H36A128.7°155.9°
C36C35C34H34118.4°154.0°
C36C35C34H34A121.6°82.7°
C36C35H35H35A121.3°123.9°
C35C36H36H36A120.4°122.3°
H13C13C14H140.5°0.0°
H15C15C14H140.2°0.3°
H20C20C19H190.1°0.3°
H22C22C23H230.5°0.1°
H28C28C27H27120.1°86.1°
H28C28C27H27A0.1°36.3°
H28C28C29H295.4°35.2°
H28C28C29H29A125.4°88.1°
H28AC28C27H270.1°37.7°
H28AC28C27H27A119.9°160.1°
H28AC28C29H29114.7°159.0°
H28AC28C29H29A5.3°35.8°
HN8N8C9H9154.6°119.9°
HN8N8C9H9A85.4°120.0°
H29C29C30H30113.3°144.4°
H29AC29C30H306.7°21.2°
H30C30C31H31170.9°179.0°
H30C30C31H31A51.0°61.1°
H33C33C34H3411.4°21.3°
H33C33C34H34A108.6°144.5°
H33AC33C34H34131.4°99.9°
H33AC33C34H34A11.4°23.3°
H34C34C35H351.7°35.9°
H34C34C35H35A121.6°87.9°
H34AC34C35H35118.4°159.2°
H34AC34C35H35A1.6°35.4°
H35C35C36H36128.7°160.2°
H35C35C36H36A8.7°37.8°
H35AC35C36H368.7°36.3°
H35AC35C36H36A111.3°86.0°

248636

PDB entries from 2026-02-04

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