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SummaryGeometryRelated PDB entries

HEI

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C02C01sing1.53Å1.55Å
C03C02sing1.51Å1.51Å
N04C03doub1.33Å1.34ÅAromatic
C05N04sing1.32Å1.33ÅAromatic
N06C05sing1.39Å1.35Å
N07C05doub1.33Å1.34ÅAromatic
C08N07sing1.33Å1.34ÅAromatic
N09C08sing1.39Å1.35Å
C10C08doub1.40Å1.41ÅAromatic
O11C10sing1.36Å1.39Å
C12O11sing1.43Å1.46Å
C13C12sing1.53Å1.53Å
C14C13sing1.53Å1.53Å
O15C14sing1.43Å1.43Å
C16O15sing1.36Å1.38Å
C17C16doub1.38Å1.38ÅAromatic
C18C17sing1.38Å1.40ÅAromatic
C19C18doub1.38Å1.37ÅAromatic
C20C19sing1.38Å1.39ÅAromatic
C21C20doub1.39Å1.39ÅAromatic
N22C21sing1.40Å1.39Å
C23N22sing1.47Å1.48Å
C24C23sing1.53Å1.54Å
C25C24sing1.53Å1.54Å
C27C26sing1.53Å1.53Å
C26C25sing1.53Å1.52Å
C28C25sing1.51Å1.56Å
O29C28doub1.21Å1.25Å
O30C28sing1.34Å1.25Å
C03C10sing1.38Å1.36ÅAromatic
C16C21sing1.39Å1.41ÅAromatic
N22C27sing1.47Å1.47Å
C01H012sing1.09Å1.10Å
C01H011sing1.09Å1.10Å
C01H013sing1.09Å1.10Å
C02H021sing1.09Å1.10Å
C02H022sing1.09Å1.10Å
C12H121sing1.09Å1.10Å
C12H122sing1.09Å1.10Å
C13H132sing1.09Å1.10Å
C13H131sing1.09Å1.10Å
C14H142sing1.09Å1.10Å
C14H141sing1.09Å1.10Å
C17H171sing1.08Å1.08Å
C18H181sing1.08Å1.08Å
C19H191sing1.08Å1.08Å
C20H201sing1.08Å1.08Å
C23H232sing1.09Å1.10Å
C23H231sing1.09Å1.10Å
C24H242sing1.09Å1.10Å
C24H241sing1.09Å1.10Å
C25H251sing1.09Å1.10Å
C26H261sing1.09Å1.10Å
C26H262sing1.09Å1.10Å
C27H272sing1.09Å1.10Å
C27H271sing1.09Å1.10Å
N06H062sing0.97Å1.00Å
N06H061sing0.97Å1.00Å
N09H092sing0.97Å1.00Å
N09H091sing0.97Å1.00Å
O30H1sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C01C02C03109.9°109.5°
C02C01H012109.5°109.5°
C02C01H011109.5°109.4°
C02C01H013109.4°109.4°
C01C02H021109.4°109.4°
C01C02H022109.4°109.5°
C02C03N04116.7°120.3°
C02C03C10122.7°120.4°
C03C02H021109.4°109.5°
C03C02H022109.4°109.5°
C03N04C05119.4°120.9°
N04C03C10120.6°119.2°
N04C05N06117.8°119.1°
N04C05N07123.8°121.8°
N06C05N07118.4°119.1°
C05N06H062109.5°120.0°
C05N06H061109.5°120.0°
C05N07C08117.4°120.6°
N07C08N09117.9°120.5°
N07C08C10121.5°119.0°
N09C08C10120.6°120.5°
C08N09H092109.5°120.0°
C08N09H091109.5°120.0°
C08C10O11119.8°120.8°
C08C10C03117.3°118.4°
C10O11C12115.7°117.0°
O11C10C03122.8°120.8°
O11C12C13106.9°109.5°
O11C12H121110.1°109.5°
O11C12H122110.1°109.5°
C12C13C14113.2°109.5°
C13C12H121110.1°109.5°
C13C12H122110.1°109.4°
C12C13H132108.5°109.4°
C12C13H131108.5°109.5°
C13C14O15105.5°109.5°
C14C13H132108.6°109.5°
C14C13H131108.5°109.5°
C13C14H142110.4°109.5°
C13C14H141110.4°109.5°
C14O15C16120.9°117.0°
O15C14H142110.5°109.4°
O15C14H141110.4°109.4°
O15C16C17121.4°120.0°
O15C16C21117.6°120.1°
C16C17C18120.6°120.0°
C17C16C21121.0°119.9°
C16C17H171119.7°120.0°
C17C18C19119.1°120.2°
C18C17H171119.7°120.0°
C17C18H181120.4°119.9°
C18C19C20120.5°120.2°
C19C18H181120.5°119.9°
C18C19H191119.8°119.9°
C19C20C21121.8°120.0°
C20C19H191119.7°119.9°
C19C20H201119.1°120.0°
C20C21N22122.1°120.1°
C20C21C16117.0°119.8°
C21C20H201119.1°120.0°
C21N22C23120.5°111.0°
N22C21C16120.8°120.1°
C21N22C27113.5°111.0°
N22C23C24111.2°109.5°
C23N22C27112.0°111.2°
N22C23H232109.0°109.4°
N22C23H231109.0°109.5°
C23C24C25111.1°109.3°
C24C23H232109.1°109.5°
C24C23H231109.0°109.4°
C23C24H242109.0°109.5°
C23C24H241109.0°109.5°
C24C25C26111.3°109.2°
C24C25C28112.7°109.5°
C25C24H242109.1°109.5°
C25C24H241109.1°109.5°
C24C25H251108.5°109.5°
C27C26C25109.0°109.3°
C26C27N22113.2°109.5°
C27C26H261109.6°109.5°
C27C26H262109.6°109.5°
C26C27H272108.5°109.4°
C26C27H271108.5°109.5°
C26C25C28107.5°109.6°
C26C25H251108.6°109.6°
C25C26H261109.6°109.5°
C25C26H262109.6°109.5°
C25C28O29115.2°120.0°
C25C28O30115.3°120.0°
C28C25H251108.1°109.5°
O29C28O30129.5°120.0°
C28O30H1109.5°117.0°
N22C27H272108.6°109.5°
N22C27H271108.6°109.4°
H012C01H011109.5°109.5°
H012C01H013109.4°109.5°
H011C01H013109.5°109.5°
H021C02H022109.5°109.5°
H121C12H122109.5°109.4°
H132C13H131109.5°109.5°
H142C14H141109.5°109.4°
H232C23H231109.5°109.5°
H242C24H241109.5°109.5°
H261C26H262109.5°109.5°
H272C27H271109.5°109.5°
H062N06H061109.5°120.0°
H092N09H091109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C01C02C03H021120.1°119.9°
C01C02C03H022120.1°120.1°
C01C02C03N0466.9°90.4°
C01C02C03C10113.6°90.0°
C02C01H012H011120.0°120.0°
C02C01H012H013120.0°119.9°
C02C01H011H013120.0°119.9°
C01C02H021H022119.8°120.0°
C02C03N04C10179.5°179.6°
C02C03N04C05179.8°180.0°
C02C03C10C08179.9°180.0°
C02C03C10O110.3°0.1°
C03C02C01H012180.0°179.9°
C03C02C01H01160.0°59.9°
C03C02C01H01360.0°60.1°
C03C02H021H022119.8°120.1°
C03N04C05N06179.2°180.0°
C03N04C05N070.6°0.0°
N04C03C10C080.4°0.4°
N04C03C10O11179.1°179.7°
N04C03C02H02153.1°149.7°
N04C03C02H022173.0°29.7°
N04C05N06N07179.8°179.9°
N04C05N07C080.2°0.4°
C05N04C03C100.7°0.3°
N04C05N06H0620.0°0.0°
N04C05N06H061120.0°180.0°
N06C05N07C08179.6°179.7°
C05N06H062H061120.0°179.9°
C05N07C08N09179.6°180.0°
C05N07C08C100.1°0.3°
N07C05N06H062179.8°179.9°
N07C05N06H06160.2°0.0°
N07C08N09C10179.8°179.7°
N07C08C10O11179.6°179.9°
N07C08C10C030.0°0.1°
N07C08N09H0920.0°0.0°
N07C08N09H091120.0°180.0°
N09C08C10O110.2°0.2°
N09C08C10C03179.7°179.7°
C08N09H092H091120.0°180.0°
C08C10O11C03179.5°179.9°
C08C10O11C1291.7°90.1°
C10C08N09H092179.8°179.7°
C10C08N09H09159.7°0.2°
C10O11C12C13169.7°180.0°
C10O11C12H12150.1°60.0°
C10O11C12H12270.7°60.0°
O11C12C13H121119.6°120.1°
O11C12C13H122119.6°120.0°
O11C12C13C1462.4°180.0°
C12O11C10C0388.7°90.1°
O11C12H121H122121.2°120.0°
O11C12C13H132177.0°60.0°
O11C12C13H13158.2°60.0°
C12C13C14H132120.6°119.9°
C12C13C14H131120.6°120.0°
C12C13C14O1568.2°180.0°
C13C12H121H122121.2°119.9°
C12C13H132H131118.3°120.0°
C12C13C14H142172.5°60.0°
C12C13C14H14151.2°60.0°
C13C14O15H142119.4°120.1°
C13C14O15H141119.4°120.0°
C13C14O15C16162.6°180.0°
C14C13C12H12157.2°59.9°
C14C13C12H122178.0°60.0°
C14C13H132H131118.3°120.1°
C13C14H142H141121.8°120.1°
C14O15C16C178.6°0.3°
C14O15C16C21170.0°180.0°
O15C14C13H13252.4°60.0°
O15C14C13H131171.3°60.0°
O15C14H142H141121.8°119.9°
O15C16C17C21178.5°179.7°
O15C16C17C18179.3°180.0°
O15C16C21C20179.5°179.7°
O15C16C21N222.4°0.0°
C16O15C14H14278.0°59.9°
C16O15C14H14143.3°60.0°
O15C16C17H1710.8°0.1°
C16C17C18H171180.0°180.0°
C16C17C18C190.2°0.0°
C17C16C21C200.9°0.6°
C17C16C21N22179.0°179.7°
C16C17C18H181179.8°180.0°
C17C18C19H181180.0°180.0°
C17C18C19C200.0°0.0°
C18C17C16C210.7°0.3°
C17C18C19H191180.0°179.9°
C18C19C20H191180.0°179.9°
C18C19C20C210.2°0.3°
C19C18C17H171179.8°179.9°
C18C19C20H201179.8°180.0°
C19C20C21H201180.0°179.7°
C19C20C21N22178.7°179.7°
C19C20C21C160.7°0.6°
C20C19C18H181180.0°180.0°
C20C21N22C16178.0°179.7°
C20C21N22C2325.1°60.2°
C20C21N22C27111.8°63.9°
C21C20C19H191179.8°179.8°
C21N22C23C27137.5°124.1°
C21N22C23C24167.3°174.2°
C21N22C27C26162.0°174.1°
N22C21C20H2011.2°0.0°
C21N22C23H23272.4°54.2°
C21N22C23H23147.0°65.8°
C21N22C27H27277.4°65.9°
C21N22C27H27141.5°54.2°
N22C23C24H232120.3°120.0°
N22C23C24H231120.3°120.0°
N22C23C24C2554.0°59.2°
C23N22C27C2657.4°61.8°
C23N22C21C16156.9°120.0°
N22C23H232H231119.2°120.0°
N22C23C24H242174.2°179.1°
N22C23C24H24166.3°60.8°
C23N22C27H27263.1°58.2°
C23N22C27H271178.0°178.2°
C23C24C25H242120.3°119.9°
C23C24C25H241120.2°120.0°
C23C24C25C2654.4°57.7°
C23C24C25C28175.2°177.6°
C24C23N22C2755.2°61.8°
C24C23H232H231119.2°120.0°
C23C24H242H241119.2°120.0°
C23C24C25H25165.1°62.3°
C24C25C26C2754.2°57.7°
C24C25C26C28123.9°119.9°
C24C25C26H251119.4°119.9°
C24C25C28H251119.9°120.1°
C24C25C28O2931.5°0.0°
C24C25C28O30150.3°180.0°
C25C24C23H23266.3°179.2°
C25C24C23H231174.2°60.8°
C25C24H242H241119.3°120.1°
C24C25C26H26165.7°177.6°
C24C25C26H262174.1°62.3°
C27C26C25H261119.9°119.9°
C27C26C25H262120.0°120.0°
C27C26C25C28178.1°177.6°
C26C27N22H272120.5°120.0°
C26C27N22H271120.6°120.0°
C27C26C25H25165.2°62.2°
C27C26H261H262120.2°120.1°
C26C27H272H271118.3°120.0°
C26C25C28H251117.1°120.2°
C26C25C28O2991.6°119.7°
C26C25C28O3086.6°60.3°
C25C26C27N2256.1°59.2°
C26C25C24H242174.6°177.6°
C26C25C24H24165.9°62.3°
C25C26H261H262120.2°120.1°
C25C26C27H27264.5°60.8°
C25C26C27H271176.6°179.2°
C25C28O29O30177.9°180.0°
C28C25C24H24264.5°62.4°
C28C25C24H24155.0°57.7°
C28C25C26H26158.1°62.5°
C28C25C26H26262.0°57.6°
C25C28O30H1177.9°180.0°
O29C28C25H251151.4°120.1°
O29C28O30H10.0°0.0°
O30C28C25H25130.4°59.9°
C10C03C02H021126.3°29.9°
C10C03C02H0226.5°149.9°
C16C21N22C2766.2°115.8°
C21C16C17H171179.3°179.8°
C16C21C20H201179.3°179.7°
C27N22C23H23265.0°178.2°
C27N22C23H231175.5°58.2°
N22C27C26H26163.9°179.1°
N22C27C26H262176.0°60.8°
N22C27H272H271118.3°120.0°
H012C01H011H013120.0°120.1°
H012C01C02H02159.9°60.0°
H012C01C02H02259.9°60.0°
H011C01C02H02160.1°60.0°
H011C01C02H022179.9°180.0°
H013C01C02H021179.9°180.0°
H013C01C02H02260.1°60.0°
H121C12C13H13263.4°60.0°
H121C12C13H131177.7°180.0°
H122C12C13H13257.4°180.0°
H122C12C13H13161.4°60.1°
H132C13C14H14267.0°180.0°
H132C13C14H141171.8°59.9°
H131C13C14H14251.9°60.0°
H131C13C14H14169.3°180.0°
H171C17C18H1810.2°0.0°
H181C18C19H1910.0°0.0°
H191C19C20H2010.2°0.1°
H232C23C24H24254.0°60.9°
H232C23C24H241173.4°59.2°
H231C23C24H24265.5°59.2°
H231C23C24H24154.0°179.2°
H242C24C25H25155.2°57.7°
H241C24C25H251174.7°177.8°
H251C25C26H261174.9°57.7°
H251C25C26H26254.8°177.8°
H261C26C27H272175.6°59.1°
H261C26C27H27156.7°60.9°
H262C26C27H27255.4°179.2°
H262C26C27H27163.4°59.2°

248335

PDB entries from 2026-01-28

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