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965

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O37C35sing1.34Å1.23Å
O37H37sing0.97Å0.95Å
C35O36doub1.21Å1.25Å
C35C34sing1.51Å1.50Å
C34C32sing1.51Å1.52Å
C34H341sing1.09Å1.10Å
C34H342sing1.09Å1.10Å
C32C31doub1.38Å1.39ÅAromatic
C32C33sing1.38Å1.40ÅAromatic
C31C30sing1.38Å1.39ÅAromatic
C31H31sing1.08Å1.08Å
C30C29doub1.38Å1.39ÅAromatic
C30H30sing1.08Å1.08Å
C29C28sing1.39Å1.39ÅAromatic
C29H29sing1.08Å1.08Å
C28O27sing1.36Å1.36Å
C28C33doub1.39Å1.39ÅAromatic
O27C26sing1.43Å1.41Å
C26C25sing1.53Å1.50Å
C26H261sing1.09Å1.10Å
C26H262sing1.09Å1.10Å
C25C17sing1.53Å1.52Å
C25H251sing1.09Å1.10Å
C25H252sing1.09Å1.10Å
C17N09sing1.47Å1.46Å
C17H171sing1.09Å1.10Å
C17H172sing1.09Å1.10Å
N09C16sing1.47Å1.45Å
N09C08sing1.47Å1.46Å
C16C18sing1.51Å1.50Å
C16H161sing1.09Å1.10Å
C16H162sing1.09Å1.10Å
C18C23doub1.38Å1.38ÅAromatic
C18C19sing1.38Å1.47ÅAromatic
C23C22sing1.38Å1.39ÅAromatic
C23H23sing1.08Å1.08Å
C22C21doub1.38Å1.40ÅAromatic
C22H22sing1.08Å1.08Å
C21C20sing1.38Å1.39ÅAromatic
C21H21sing1.08Å1.08Å
C20C19doub1.38Å1.47ÅAromatic
C20C39sing1.51Å1.51Å
C19CL4sing1.74Å1.78Å
C39F41sing1.40Å1.34Å
C39F40sing1.40Å1.32Å
C39F42sing1.40Å1.32Å
C08C07sing1.53Å1.54Å
C08H081sing1.09Å1.10Å
C08H082sing1.09Å1.10Å
C07C01sing1.51Å1.49Å
C07C10sing1.51Å1.48Å
C07H07sing1.09Å1.10Å
C01C02doub1.38Å1.40ÅAromatic
C01C06sing1.38Å1.39ÅAromatic
C02C03sing1.38Å1.39ÅAromatic
C02H02sing1.08Å1.08Å
C03C04doub1.38Å1.39ÅAromatic
C03H03sing1.08Å1.08Å
C04C05sing1.38Å1.39ÅAromatic
C04H04sing1.08Å1.08Å
C05C06doub1.38Å1.40ÅAromatic
C05H05sing1.08Å1.08Å
C06H06sing1.08Å1.08Å
C10C15sing1.38Å1.40ÅAromatic
C10C11doub1.38Å1.38ÅAromatic
C15C14doub1.38Å1.40ÅAromatic
C15H15sing1.08Å1.08Å
C14C13sing1.38Å1.39ÅAromatic
C14H14sing1.08Å1.08Å
C13C12doub1.38Å1.39ÅAromatic
C13H13sing1.08Å1.08Å
C12C11sing1.38Å1.39ÅAromatic
C12H12sing1.08Å1.08Å
C11H111sing1.08Å1.08Å
C33H33sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C35O37H37109.5°117.0°
O37C35O36122.0°120.0°
O37C35C34123.4°120.0°
O36C35C34114.6°120.0°
C35C34C32110.6°109.5°
C35C34H341109.1°109.4°
C35C34H342109.1°109.5°
C32C34H341109.1°109.5°
C32C34H342109.1°109.5°
C34C32C31118.1°120.0°
C34C32C33122.0°120.0°
H341C34H342109.8°109.5°
C31C32C33119.8°120.0°
C32C31C30120.6°120.1°
C32C31H31119.7°119.9°
C32C33C28119.4°119.9°
C32C33H33120.3°120.0°
C30C31H31119.7°120.0°
C31C30C29119.6°120.1°
C31C30H30120.2°119.9°
C29C30H30120.2°120.0°
C30C29C28120.0°119.9°
C30C29H29120.0°120.0°
C28C29H29120.0°120.0°
C29C28O27118.8°120.0°
C29C28C33120.7°119.9°
O27C28C33120.4°120.0°
C28O27C26120.6°117.0°
C28C33H33120.3°120.1°
O27C26C25108.2°109.4°
O27C26H261109.9°109.4°
O27C26H262109.9°109.5°
C25C26H261109.9°109.5°
C25C26H262109.9°109.5°
C26C25C17110.0°109.4°
C26C25H251109.3°109.5°
C26C25H252109.3°109.5°
H261C26H262109.0°109.5°
C17C25H251109.3°109.5°
C17C25H252109.3°109.4°
C25C17N09110.7°109.5°
C25C17H171109.1°109.5°
C25C17H172109.1°109.5°
H251C25H252109.6°109.5°
N09C17H171109.0°109.5°
N09C17H172109.0°109.4°
C17N09C16118.2°111.0°
C17N09C08120.3°111.0°
H171C17H172109.9°109.5°
C16N09C08119.3°111.0°
N09C16C18113.6°109.5°
N09C16H161108.1°109.5°
N09C16H162108.1°109.5°
N09C08C07114.9°109.5°
N09C08H081107.7°109.5°
N09C08H082107.7°109.5°
C18C16H161108.1°109.5°
C18C16H162108.1°109.4°
C16C18C23122.5°120.0°
C16C18C19118.1°120.0°
H161C16H162110.8°109.5°
C23C18C19119.4°120.0°
C18C23C22119.8°120.0°
C18C23H23120.1°120.0°
C18C19C20119.6°120.0°
C18C19CL4120.0°120.0°
C22C23H23120.1°120.1°
C23C22C21122.6°120.0°
C23C22H22118.7°119.9°
C21C22H22118.7°120.0°
C22C21C20121.4°120.0°
C22C21H21119.3°120.0°
C20C21H21119.3°120.0°
C21C20C19117.2°119.9°
C21C20C39124.0°120.0°
C19C20C39118.8°120.1°
C20C19CL4120.4°120.0°
C20C39F41107.2°109.5°
C20C39F40111.6°109.4°
C20C39F42110.9°109.4°
F41C39F40110.9°109.5°
F41C39F42109.0°109.5°
F40C39F42107.3°109.5°
C07C08H081107.7°109.5°
C07C08H082107.7°109.4°
C08C07C01112.1°109.5°
C08C07C10110.3°109.5°
C08C07H07107.3°109.5°
H081C08H082111.2°109.4°
C01C07C10110.2°109.4°
C01C07H07107.4°109.5°
C07C01C02122.6°120.0°
C07C01C06118.9°120.0°
C10C07H07109.3°109.5°
C07C10C15120.8°120.0°
C07C10C11119.3°120.0°
C02C01C06118.5°120.0°
C01C02C03121.3°120.0°
C01C02H02119.4°120.0°
C01C06C05119.8°120.0°
C01C06H06120.1°120.0°
C03C02H02119.3°120.0°
C02C03C04119.9°120.0°
C02C03H03120.1°120.0°
C04C03H03120.0°120.0°
C03C04C05119.0°120.0°
C03C04H04120.5°120.0°
C05C04H04120.5°120.0°
C04C05C06121.4°120.0°
C04C05H05119.3°120.0°
C06C05H05119.3°120.0°
C05C06H06120.1°120.0°
C15C10C11119.8°119.9°
C10C15C14120.6°120.0°
C10C15H15119.7°120.0°
C10C11C12119.5°120.0°
C10C11H111120.2°120.0°
C14C15H15119.7°120.0°
C15C14C13119.3°120.0°
C15C14H14120.4°120.0°
C13C14H14120.4°120.0°
C14C13C12119.4°120.0°
C14C13H13120.3°120.0°
C12C13H13120.3°120.1°
C13C12C11121.3°120.0°
C13C12H12119.4°120.0°
C11C12H12119.4°120.0°
C12C11H111120.3°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O37C35O36C34177.5°180.0°
O37C35C34C3234.3°180.0°
O37C35C34H34185.7°60.0°
O37C35C34H342154.3°60.0°
H37O37C35O360.0°0.0°
H37O37C35C34177.3°180.0°
O36C35C34C32148.2°0.0°
O36C35C34H34191.8°120.0°
O36C35C34H34228.2°120.0°
C35C34C32H341120.0°120.0°
C35C34C32H342120.0°120.0°
C35C34H341H342119.6°120.0°
C35C34C32C3185.8°90.0°
C35C34C32C3391.0°90.3°
C32C34H341H342119.5°120.0°
C34C32C31C33176.8°179.8°
C34C32C31C30176.9°180.0°
C34C32C31H313.1°0.1°
C34C32C33C28176.5°179.7°
C34C32C33H333.5°0.0°
H341C34C32C31154.2°30.0°
H341C34C32C3329.1°149.7°
H342C34C32C3134.2°150.0°
H342C34C32C33149.0°29.7°
C32C31C30H31180.0°180.0°
C32C31C30C290.1°0.1°
C32C31C30H30179.9°180.0°
C31C32C33C280.2°0.5°
C31C32C33H33179.9°179.8°
C33C32C31C300.2°0.2°
C33C32C31H31179.8°179.7°
C32C33C28C290.5°0.5°
C32C33C28O27178.3°179.7°
C32C33C28H33180.0°179.7°
C31C30C29H30180.0°179.9°
C31C30C29C280.3°0.1°
C31C30C29H29179.7°180.0°
H31C31C30C29179.9°180.0°
H31C31C30H300.1°0.1°
C30C29C28H29180.0°180.0°
C30C29C28O27178.4°180.0°
C30C29C28C330.6°0.2°
H30C30C29C28179.7°180.0°
H30C30C29H290.2°0.1°
C29C28O27C33177.8°179.7°
C29C28O27C2657.5°0.0°
C29C28C33H33179.5°179.8°
H29C29C28O271.6°0.0°
H29C29C28C33179.4°179.7°
C28O27C26C25160.2°180.0°
C28O27C26H26140.2°60.0°
C28O27C26H26279.8°60.0°
O27C28C33H331.7°0.1°
C33C28O27C26124.7°179.7°
O27C26C25H261120.0°120.0°
O27C26C25H262120.0°120.0°
O27C26H261H262120.5°120.0°
O27C26C25C17166.6°180.0°
O27C26C25H25173.4°60.0°
O27C26C25H25246.6°60.0°
C25C26H261H262120.5°120.0°
C26C25C17H251120.0°120.0°
C26C25C17H252120.0°120.0°
C26C25H251H252119.8°120.0°
C26C25C17N09139.2°180.0°
C26C25C17H17119.2°60.0°
C26C25C17H172100.8°60.1°
H261C26C25C1746.6°60.0°
H261C26C25H251166.6°179.9°
H261C26C25H25273.4°59.9°
H262C26C25C1773.4°60.1°
H262C26C25H25146.6°60.0°
H262C26C25H252166.6°180.0°
C17C25H251H252119.8°120.0°
C25C17N09H171120.0°120.1°
C25C17N09H172120.0°120.0°
C25C17H171H172119.5°120.0°
C25C17N09C1645.8°66.0°
C25C17N09C08151.2°170.0°
H251C25C17N09100.8°59.9°
H251C25C17H171139.2°180.0°
H251C25C17H17219.2°60.0°
H252C25C17N0919.2°60.0°
H252C25C17H171100.8°60.0°
H252C25C17H172139.2°180.0°
N09C17H171H172119.4°119.9°
C17N09C16C08163.2°124.0°
C17N09C16C18140.4°174.3°
C17N09C16H16199.6°65.8°
C17N09C16H16220.4°54.3°
C17N09C08C0749.5°63.8°
C17N09C08H08170.5°56.2°
C17N09C08H082169.5°176.3°
H171C17N09C16165.8°173.9°
H171C17N09C0831.1°50.0°
H172C17N09C1674.2°54.0°
H172C17N09C0888.8°70.0°
N09C16C18H161120.0°120.0°
N09C16C18H162120.0°120.0°
N09C16H161H162118.3°120.0°
N09C16C18C2348.4°93.6°
N09C16C18C19131.8°86.1°
C16N09C08C07147.6°172.2°
C16N09C08H08192.4°67.7°
C16N09C08H08227.6°52.3°
C08N09C16C1856.4°61.8°
C08N09C16H16163.6°58.2°
C08N09C16H162176.3°178.2°
N09C08C07H081120.0°120.1°
N09C08C07H082120.0°120.0°
N09C08H081H082117.8°120.1°
N09C08C07C01157.1°175.8°
N09C08C07C1079.6°64.2°
N09C08C07H0739.4°55.8°
C18C16H161H162118.3°120.0°
C16C18C23C19179.8°179.7°
C16C18C23C22179.7°180.0°
C16C18C23H230.3°0.0°
C16C18C19C20179.4°179.7°
C16C18C19CL40.2°0.0°
H161C16C18C23168.4°146.4°
H161C16C18C1911.8°33.9°
H162C16C18C2371.6°26.4°
H162C16C18C19108.2°153.8°
C18C23C22H23180.0°179.9°
C18C23C22C210.2°0.1°
C18C23C22H22179.8°180.0°
C23C18C19C200.8°0.6°
C23C18C19CL4180.0°179.7°
C19C18C23C220.5°0.2°
C19C18C23H23179.4°179.7°
C18C19C20C210.7°0.6°
C18C19C20CL4179.2°179.7°
C18C19C20C39178.5°179.6°
C23C22C21H22180.0°179.9°
C23C22C21C200.0°0.1°
C23C22C21H21180.0°180.0°
H23C23C22C21179.8°180.0°
H23C23C22H220.2°0.1°
C22C21C20H21180.0°180.0°
C22C21C20C190.3°0.2°
C22C21C20C39178.9°180.0°
H22C22C21C20180.0°180.0°
H22C22C21H210.1°0.1°
C21C20C19C39179.2°179.8°
C21C20C19CL4179.9°179.7°
C21C20C39F41116.5°1.7°
C21C20C39F405.1°118.3°
C21C20C39F42124.6°121.8°
H21C21C20C19179.7°179.7°
H21C21C20C391.2°0.1°
C19C20C39F4162.6°178.5°
C19C20C39F40175.8°61.5°
C19C20C39F4256.3°58.4°
C39C20C19CL40.7°0.1°
C20C39F41F40122.0°120.0°
C20C39F41F42120.1°120.0°
C20C39F40F42121.6°119.9°
F41C39F40F42119.0°120.1°
C07C08H081H082117.8°119.9°
C08C07C01C10123.3°120.0°
C08C07C01H07117.6°120.0°
C08C07C10H07117.8°120.0°
C08C07C01C0232.5°128.3°
C08C07C01C06147.3°51.3°
C08C07C10C1559.4°53.4°
C08C07C10C11120.4°126.4°
H081C08C07C0137.1°55.7°
H081C08C07C10160.4°175.7°
H081C08C07H0780.6°64.3°
H082C08C07C0182.9°64.2°
H082C08C07C1040.4°55.8°
H082C08C07H07159.4°175.8°
C01C07C10H07117.9°120.0°
C07C01C02C06179.7°179.6°
C07C01C02C03179.7°180.0°
C07C01C02H020.3°0.1°
C07C01C06C05179.0°179.8°
C07C01C06H061.0°0.1°
C01C07C10C1565.0°66.6°
C01C07C10C11115.3°113.6°
C10C07C01C0290.9°111.7°
C10C07C01C0689.4°68.7°
C07C10C15C11179.7°179.8°
C07C10C15C14178.6°180.0°
C07C10C15H151.4°0.0°
C07C10C11C12179.6°179.8°
C07C10C11H1110.5°0.1°
H07C07C01C02150.1°8.3°
H07C07C01C0629.6°171.3°
H07C07C10C15177.2°173.4°
H07C07C10C112.6°6.3°
C01C02C03H02180.0°179.9°
C01C02C03C040.4°0.1°
C01C02C03H03179.6°179.9°
C02C01C06C050.7°0.6°
C02C01C06H06179.3°179.7°
C06C01C02C030.0°0.4°
C06C01C02H02180.0°179.7°
C01C06C05C041.8°0.5°
C01C06C05H06180.0°179.7°
C01C06C05H05178.2°179.6°
C02C03C04H03180.0°180.0°
C02C03C04C051.5°0.0°
C02C03C04H04178.5°180.0°
H02C02C03C04179.6°180.0°
H02C02C03H030.4°0.0°
C03C04C05H04180.0°180.0°
C03C04C05C062.2°0.2°
C03C04C05H05177.8°179.9°
H03C03C04C05178.5°180.0°
H03C03C04H041.5°0.0°
C04C05C06H05180.0°179.9°
C04C05C06H06178.2°179.8°
H04C04C05C06177.8°179.8°
H04C04C05H052.2°0.1°
H05C05C06H061.8°0.1°
C10C15C14H15180.0°180.0°
C10C15C14C131.9°0.0°
C10C15C14H14178.1°180.0°
C15C10C11C120.2°0.4°
C15C10C11H111179.8°179.7°
C11C10C15C141.2°0.2°
C11C10C15H15178.8°179.8°
C10C11C12C130.0°0.4°
C10C11C12H111180.0°179.8°
C10C11C12H12180.0°179.8°
C15C14C13H14180.0°180.0°
C15C14C13C121.7°0.0°
C15C14C13H13178.3°179.9°
H15C15C14C13178.1°180.0°
H15C15C14H141.9°0.0°
C14C13C12H13180.0°179.9°
C14C13C12C110.8°0.2°
C14C13C12H12179.2°180.0°
H14C14C13C12178.3°180.0°
H14C14C13H131.7°0.0°
C13C12C11H12180.0°179.8°
C13C12C11H111180.0°179.7°
H13C13C12C11179.2°179.8°
H13C13C12H120.8°0.1°
H12C12C11H1110.0°0.1°

246704

PDB entries from 2025-12-24

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