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RAL

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2doub1.37Å1.40ÅAromatic
C1C14sing1.41Å1.38ÅAromatic
C1H1sing1.08Å1.10Å
C2C3sing1.39Å1.39ÅAromatic
C2H2sing1.08Å1.10Å
C3O3sing1.36Å1.38Å
C3C4doub1.39Å1.41ÅAromatic
O3HO3sing0.97Å0.95Å
C4C5sing1.38Å1.35ÅAromatic
C4H4sing1.08Å1.10Å
C5S6sing1.77Å1.68ÅAromatic
C5C14doub1.41Å1.42ÅAromatic
S6C7sing1.78Å1.68ÅAromatic
C7C8sing1.48Å1.49ÅAromatic
C7C15doub1.39Å1.43ÅAromatic
C8C9sing1.40Å1.37ÅAromatic
C8C13doub1.40Å1.39ÅAromatic
C9C10doub1.38Å1.40ÅAromatic
C9H9sing1.08Å1.10Å
C10C11sing1.39Å1.38ÅAromatic
C10H10sing1.08Å1.10Å
C11O11sing1.36Å1.38Å
C11C12doub1.39Å1.39ÅAromatic
O11HO1sing0.97Å0.95Å
C12C13sing1.38Å1.39ÅAromatic
C12H12sing1.08Å1.10Å
C13H13sing1.08Å1.10Å
C14C15sing1.47Å1.47ÅAromatic
C15C16sing1.46Å1.39Å
C16O16doub1.22Å1.24Å
C16C17sing1.48Å1.46Å
C17C18doub1.40Å1.39ÅAromatic
C17C22sing1.40Å1.39ÅAromatic
C18C19sing1.38Å1.42ÅAromatic
C18H18sing1.08Å1.10Å
C19C20doub1.39Å1.38ÅAromatic
C19H19sing1.08Å1.10Å
C20C21sing1.39Å1.39ÅAromatic
C20O23sing1.36Å1.39Å
C21C22doub1.38Å1.36ÅAromatic
C21H21sing1.08Å1.10Å
C22H22sing1.08Å1.10Å
O23C24sing1.43Å1.41Å
C24C25sing1.53Å1.52Å
C24H241sing1.09Å1.12Å
C24H242sing1.09Å1.12Å
C25N26sing1.47Å1.48Å
C25H251sing1.09Å1.11Å
C25H252sing1.09Å1.12Å
N26C27sing1.47Å1.49Å
N26C31sing1.47Å1.47Å
C27C28sing1.53Å1.53Å
C27H271sing1.09Å1.11Å
C27H272sing1.09Å1.12Å
C28C29sing1.53Å1.54Å
C28H281sing1.09Å1.11Å
C28H282sing1.09Å1.12Å
C29C30sing1.53Å1.53Å
C29H291sing1.09Å1.11Å
C29H292sing1.09Å1.11Å
C30C31sing1.53Å1.53Å
C30H301sing1.09Å1.11Å
C30H302sing1.09Å1.12Å
C31H311sing1.09Å1.12Å
C31H312sing1.09Å1.11Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C14121.8°120.7°
C2C1H1119.6°119.7°
C1C2C3118.7°121.2°
C1C2H2120.9°119.4°
C14C1H1118.6°119.6°
C1C14C5118.7°116.9°
C1C14C15131.0°128.2°
C3C2H2120.5°119.4°
C2C3O3118.7°120.3°
C2C3C4119.9°119.3°
O3C3C4121.4°120.3°
C3O3HO3118.8°106.9°
C3C4C5121.0°119.7°
C3C4H4121.7°120.2°
C5C4H4117.3°120.2°
C4C5S6130.6°133.4°
C4C5C14120.0°122.1°
S6C5C14109.4°104.4°
C5S6C799.0°99.3°
C5C14C15110.3°115.0°
S6C7C8124.6°128.4°
S6C7C15107.0°103.3°
C8C7C15128.3°128.3°
C7C8C9121.6°120.1°
C7C8C13120.4°120.1°
C7C15C14114.3°117.9°
C7C15C16121.4°121.1°
C9C8C13118.0°119.8°
C8C9C10122.3°119.9°
C8C9H9117.6°120.0°
C8C13C12121.1°119.9°
C8C13H13119.2°120.1°
C10C9H9120.1°120.1°
C9C10C11119.1°120.1°
C9C10H10121.0°119.9°
C11C10H10120.0°120.0°
C10C11O11119.8°119.9°
C10C11C12119.5°120.2°
O11C11C12120.6°119.9°
C11O11HO1119.8°106.8°
C11C12C13120.0°120.1°
C11C12H12119.8°119.9°
C13C12H12120.2°119.9°
C12C13H13119.7°120.0°
C14C15C16124.3°121.0°
C15C16O16117.8°120.0°
C15C16C17122.5°120.0°
O16C16C17119.7°120.1°
C16C17C18121.2°120.0°
C16C17C22120.8°120.1°
C18C17C22118.0°119.9°
C17C18C19123.5°119.9°
C17C18H18117.3°120.1°
C17C22C21119.2°119.9°
C17C22H22121.2°120.0°
C19C18H18119.1°120.0°
C18C19C20116.0°120.1°
C18C19H19123.1°120.0°
C20C19H19120.9°120.0°
C19C20C21120.3°120.2°
C19C20O23128.7°119.9°
C21C20O23111.0°119.9°
C20C21C22123.1°120.1°
C20C21H21119.3°120.0°
C20O23C24115.8°106.8°
C22C21H21117.6°120.0°
C21C22H22119.6°120.1°
O23C24C25105.2°109.5°
O23C24H241113.9°109.4°
O23C24H242113.8°109.4°
C25C24H241113.8°109.5°
C25C24H242113.9°109.5°
C24C25N26119.1°109.5°
C24C25H251108.7°109.5°
C24C25H252108.7°109.5°
H241C24H24296.6°109.5°
N26C25H251108.8°109.5°
N26C25H252108.7°109.5°
C25N26C27106.0°106.7°
C25N26C31113.6°106.7°
H251C25H252101.3°109.4°
C27N26C31108.3°107.3°
N26C27C28112.6°109.8°
N26C27H271111.1°109.4°
N26C27H272111.0°109.4°
N26C31C30111.5°109.7°
N26C31H311111.4°109.4°
N26C31H312111.4°109.4°
C28C27H271111.1°109.5°
C28C27H272111.1°109.5°
C27C28C29109.3°109.2°
C27C28H281112.3°109.6°
C27C28H282112.3°109.5°
H271C27H27299.3°109.3°
C29C28H281112.3°109.6°
C29C28H282112.3°109.5°
C28C29C30107.8°108.9°
C28C29H291112.8°109.5°
C28C29H292112.8°109.6°
H281C28H28298.1°109.5°
C30C29H291112.8°109.6°
C30C29H292112.8°109.6°
C29C30C31111.1°109.2°
C29C30H301111.6°109.5°
C29C30H302111.6°109.6°
H291C29H29297.6°109.6°
C31C30H301111.6°109.5°
C31C30H302111.6°109.5°
C30C31H311111.5°109.5°
C30C31H312111.5°109.4°
H301C30H30298.8°109.5°
H311C31H31298.9°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C14H1180.0°179.9°
C1C2C3H2180.0°179.9°
C1C2C3O3179.2°179.9°
C1C2C3C40.5°0.0°
C2C1C14C50.1°0.1°
C2C1C14C15178.2°179.7°
C14C1C2C30.5°0.1°
C14C1C2H2179.5°180.0°
C1C14C5C40.8°0.0°
C1C14C5S6179.2°180.0°
C1C14C5C15178.5°179.7°
C1C14C15C7178.9°179.8°
C1C14C15C162.8°0.0°
H1C1C2C3179.4°180.0°
H1C1C2H20.5°0.1°
H1C1C14C5179.9°180.0°
H1C1C14C151.8°0.4°
C2C3O3C4179.8°180.0°
C2C3O3HO3180.0°90.0°
C2C3C4C50.1°0.0°
C2C3C4H4179.9°179.9°
H2C2C3O30.7°0.0°
H2C2C3C4179.5°180.0°
O3C3C4C5179.9°180.0°
O3C3C4H40.1°0.1°
C4C3O3HO30.2°90.0°
C3C4C5H4180.0°179.9°
C3C4C5S6179.1°180.0°
C3C4C5C140.8°0.0°
C4C5S6C14179.9°180.0°
C4C5S6C7179.4°180.0°
C4C5C14C15179.2°179.7°
H4C4C5S60.9°0.1°
H4C4C5C14179.2°179.9°
C5S6C7C8179.6°180.0°
C5S6C7C150.1°0.3°
S6C5C14C150.7°0.3°
C14C5S6C70.5°0.0°
C5C14C15C70.6°0.5°
C5C14C15C16178.9°179.7°
S6C7C8C15179.4°179.7°
S6C7C8C956.8°50.0°
S6C7C8C13123.7°129.9°
S6C7C15C140.3°0.5°
S6C7C15C16178.6°179.8°
C7C8C9C13179.5°179.9°
C7C8C9C10179.3°180.0°
C7C8C9H90.6°0.1°
C7C8C13C12179.4°179.7°
C7C8C13H130.6°0.1°
C8C7C15C14179.2°179.8°
C8C7C15C160.8°0.0°
C15C7C8C9122.6°130.3°
C15C7C8C1357.0°49.8°
C7C15C14C16178.3°179.8°
C7C15C16O1670.9°90.5°
C7C15C16C17108.7°89.4°
C8C9C10H9180.0°179.9°
C8C9C10C110.1°0.0°
C8C9C10H10179.8°179.9°
C9C8C13C120.1°0.2°
C9C8C13H13179.9°180.0°
C13C8C9C100.2°0.1°
C13C8C9H9179.8°180.0°
C8C13C12C110.1°0.5°
C8C13C12H13180.0°179.8°
C8C13C12H12179.9°180.0°
C9C10C11H10179.9°180.0°
C9C10C11O11179.8°180.0°
C9C10C11C120.0°0.3°
H9C9C10C11179.9°179.9°
H9C9C10H100.2°0.0°
C10C11O11C12179.8°179.7°
C10C11O11HO1179.9°85.1°
C10C11C12C130.0°0.5°
C10C11C12H12180.0°180.0°
H10C10C11O110.3°0.0°
H10C10C11C12179.9°179.8°
O11C11C12C13179.8°179.7°
O11C11C12H120.2°0.2°
C12C11O11HO10.2°95.2°
C11C12C13H12180.0°179.5°
C11C12C13H13180.0°179.7°
H12C12C13H130.1°0.2°
C14C15C16O16107.3°89.8°
C14C15C16C1773.1°90.3°
C15C16O16C17179.6°179.9°
C15C16C17C18173.1°174.8°
C15C16C17C227.4°5.5°
O16C16C17C187.4°5.3°
O16C16C17C22172.2°174.4°
C16C17C18C22179.6°179.7°
C16C17C18C19179.9°180.0°
C16C17C18H180.1°0.1°
C16C17C22C21179.4°179.7°
C16C17C22H220.7°0.3°
C17C18C19H18179.9°179.9°
C17C18C19C200.5°0.0°
C17C18C19H19179.5°180.0°
C18C17C22C210.2°0.6°
C18C17C22H22179.7°180.0°
C22C17C18C190.3°0.3°
C22C17C18H18179.7°179.8°
C17C22C21C200.7°0.5°
C17C22C21H22180.0°179.4°
C17C22C21H21179.4°179.7°
C18C19C20H19179.9°180.0°
C18C19C20C210.0°0.1°
C18C19C20O23179.8°180.0°
H18C18C19C20179.6°179.9°
H18C18C19H190.5°0.1°
C19C20C21O23179.9°179.9°
C19C20C21C220.5°0.2°
C19C20C21H21179.5°180.0°
C19C20O23C2435.9°174.8°
H19C19C20C21179.9°179.9°
H19C19C20O230.3°0.0°
C20C21C22H21180.0°179.8°
C20C21C22H22179.3°179.9°
C21C20O23C24144.3°5.3°
O23C20C21C22179.6°179.7°
O23C20C21H210.3°0.1°
C20O23C24C25161.3°177.5°
C20O23C24H24136.0°62.4°
C20O23C24H24273.4°57.6°
H21C21C22H220.7°0.3°
O23C24C25H241125.3°120.0°
O23C24C25H242125.3°120.0°
O23C24H241H242119.7°120.0°
O23C24C25N2692.1°60.0°
O23C24C25H25133.2°180.0°
O23C24C25H252142.7°60.0°
C25C24H241H242119.7°120.0°
C24C25N26H251125.3°120.0°
C24C25N26H252125.2°120.0°
C24C25H251H252114.4°120.0°
C24C25N26C27161.9°180.0°
C24C25N26C3179.4°65.5°
H241C24C25N26142.6°60.0°
H241C24C25H25192.1°60.0°
H241C24C25H25217.4°180.0°
H242C24C25N2633.2°180.0°
H242C24C25H251158.5°60.0°
H242C24C25H25292.0°59.9°
N26C25H251H252114.4°120.0°
C25N26C27C31122.3°114.1°
C25N26C27C28177.5°179.7°
C25N26C27H27157.3°59.5°
C25N26C27H27252.2°60.1°
C25N26C31C30176.3°179.7°
C25N26C31H31158.5°60.2°
C25N26C31H31251.0°59.6°
H251C25N26C2772.9°60.0°
H251C25N26C3145.9°54.5°
H252C25N26C2736.6°60.0°
H252C25N26C31155.4°174.5°
N26C27C28H271125.3°120.1°
N26C27C28H272125.2°120.1°
N26C27H271H272116.9°119.7°
N26C27C28C2960.0°61.4°
N26C27C28H281174.7°178.6°
N26C27C28H28265.3°58.5°
C27N26C31C3058.8°65.6°
C27N26C31H311175.9°174.3°
C27N26C31H31266.4°54.5°
C31N26C27C2860.3°65.6°
C31N26C27H27165.0°54.5°
C31N26C27H272174.5°174.2°
N26C31C30C2959.4°61.4°
N26C31C30H311125.2°120.1°
N26C31C30H312125.2°120.0°
N26C31C30H301175.3°178.7°
N26C31C30H30265.8°58.6°
N26C31H311H312117.3°119.8°
C28C27H271H272117.0°119.9°
C27C28C29H281125.3°120.0°
C27C28C29H282125.2°119.9°
C27C28H281H282118.1°120.1°
C27C28C29C3056.0°55.6°
C27C28C29H29169.2°64.3°
C27C28C29H292178.7°175.4°
H271C27C28C2965.3°58.7°
H271C27C28H28160.0°61.3°
H271C27C28H282169.4°178.6°
H272C27C28C29174.8°178.5°
H272C27C28H28149.5°58.5°
H272C27C28H28259.9°61.6°
C29C28H281H282118.2°120.1°
C28C29C30H291125.3°119.8°
C28C29C30H292125.2°119.9°
C28C29H291H292118.7°120.3°
C28C29C30C3156.4°55.6°
C28C29C30H301178.3°175.5°
C28C29C30H30268.9°64.4°
H281C28C29C30178.6°175.6°
H281C28C29H29156.1°55.7°
H281C28C29H29253.4°64.6°
H282C28C29C3069.2°64.3°
H282C28C29H291165.5°175.9°
H282C28C29H29256.0°55.6°
C30C29H291H292118.8°120.3°
C29C30C31H301125.3°119.9°
C29C30C31H302125.2°120.0°
C29C30H301H302117.5°120.2°
C29C30C31H311175.4°178.5°
C29C30C31H31265.8°58.7°
H291C29C30C3168.9°64.2°
H291C29C30H30156.4°55.7°
H291C29C30H302165.9°175.9°
H292C29C30C31178.4°175.5°
H292C29C30H30153.1°64.6°
H292C29C30H30256.4°55.5°
C31C30H301H302117.5°120.1°
C30C31H311H312117.4°119.9°
H301C30C31H31150.1°58.6°
H301C30C31H31259.5°61.3°
H302C30C31H31159.4°61.5°
H302C30C31H312169.0°178.6°

227111

PDB entries from 2024-11-06

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