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XPG

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O15C15sing1.43Å1.43Å
C18C17sing1.53Å1.53Å
C18C19sing1.53Å1.53Å
C20C19sing1.53Å1.52Å
C16C17sing1.53Å1.53Å
C16C15sing1.53Å1.53Å
C15C14sing1.51Å1.49Å
C14C13doub1.31Å1.33Å
C13C12sing1.51Å1.49Å
O11C11sing1.43Å1.42Å
C11C12sing1.55Å1.53Å
C11C10sing1.55Å1.53Å
C12C8sing1.54Å1.54Å
C8C9sing1.51Å1.52Å
C8C7sing1.53Å1.53Å
C10C9sing1.52Å1.51Å
C9O9doub1.21Å1.22Å
C7C6sing1.53Å1.54Å
C6C5sing1.53Å1.54Å
C5C4sing1.53Å1.54Å
C4C3sing1.53Å1.54Å
C3C2sing1.53Å1.53Å
C2C1sing1.51Å1.51Å
O1BC1doub1.21Å1.25Å
C1O1Asing1.34Å1.25Å
C20H1sing1.09Å1.10Å
C20H2sing1.09Å1.10Å
C20H3sing1.09Å1.10Å
C19H4sing1.09Å1.10Å
C19H5sing1.09Å1.10Å
C18H6sing1.09Å1.10Å
C18H7sing1.09Å1.10Å
C17H8sing1.09Å1.10Å
C17H9sing1.09Å1.10Å
C16H10sing1.09Å1.10Å
C16H11sing1.09Å1.10Å
C15H12sing1.09Å1.10Å
O15H13sing0.97Å0.95Å
C14H14sing1.08Å1.08Å
C13H15sing1.08Å1.08Å
C12H16sing1.09Å1.10Å
C11H17sing1.09Å1.10Å
O11H18sing0.97Å0.95Å
C10H19sing1.09Å1.10Å
C10H20sing1.09Å1.10Å
C8H21sing1.09Å1.10Å
C7H22sing1.09Å1.10Å
C7H23sing1.09Å1.10Å
C6H24sing1.09Å1.10Å
C6H25sing1.09Å1.10Å
C5H26sing1.09Å1.10Å
C5H27sing1.09Å1.10Å
C4H28sing1.09Å1.10Å
C4H29sing1.09Å1.10Å
C3H30sing1.09Å1.10Å
C3H31sing1.09Å1.10Å
C2H32sing1.09Å1.10Å
C2H33sing1.09Å1.10Å
O1AH34sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O15C15C16108.2°109.5°
O15C15C14105.8°109.5°
O15C15H12110.2°109.4°
C15O15H13109.5°114.0°
C17C18C19113.5°109.5°
C18C17C16113.1°109.5°
C17C18H6108.5°109.5°
C17C18H7108.5°109.5°
C18C17H8108.5°109.5°
C18C17H9108.6°109.5°
C18C19C20112.7°109.4°
C18C19H4108.6°109.5°
C18C19H5108.7°109.5°
C19C18H6108.5°109.5°
C19C18H7108.4°109.5°
C19C20H1109.5°109.5°
C19C20H2109.5°109.5°
C19C20H3109.5°109.5°
C20C19H4108.7°109.4°
C20C19H5108.6°109.5°
C17C16C15113.7°109.5°
C16C17H8108.6°109.5°
C16C17H9108.6°109.4°
C17C16H10108.4°109.5°
C17C16H11108.4°109.5°
C16C15C14114.3°109.4°
C15C16H10108.4°109.4°
C15C16H11108.4°109.5°
C16C15H12108.9°109.5°
C15C14C13121.6°120.0°
C14C15H12109.4°109.5°
C15C14H14119.2°120.0°
C14C13C12124.7°120.0°
C13C14H14119.2°120.0°
C14C13H15117.7°120.0°
C13C12C11108.0°110.6°
C13C12C8114.2°110.6°
C12C13H15117.6°120.0°
C13C12H16110.8°110.5°
O11C11C12111.0°110.8°
O11C11C10111.0°110.8°
O11C11H17111.1°110.9°
C11O11H18109.5°114.0°
C12C11C10104.4°102.3°
C11C12C8103.2°103.8°
C11C12H16110.2°110.6°
C12C11H17109.5°110.8°
C11C10C9101.4°104.4°
C10C11H17109.6°110.9°
C11C10H19111.5°110.4°
C11C10H20111.4°110.4°
C12C8C9101.3°106.9°
C12C8C7117.9°110.0°
C8C12H16110.1°110.6°
C12C8H21107.9°110.0°
C9C8C7112.9°110.0°
C8C9C10112.3°107.3°
C8C9O9124.0°126.3°
C9C8H21108.2°110.0°
C8C7C6117.6°109.5°
C7C8H21108.1°109.9°
C8C7H22107.4°109.5°
C8C7H23107.4°109.5°
C10C9O9123.7°126.3°
C9C10H19111.5°110.5°
C9C10H20111.5°110.5°
C7C6C5115.0°109.5°
C6C7H22107.4°109.5°
C6C7H23107.4°109.5°
C7C6H24108.1°109.4°
C7C6H25108.1°109.5°
C6C5C4117.6°109.5°
C5C6H24108.0°109.5°
C5C6H25108.0°109.5°
C6C5H26107.4°109.4°
C6C5H27107.4°109.5°
C5C4C3114.5°109.5°
C4C5H26107.4°109.4°
C4C5H27107.4°109.5°
C5C4H28108.2°109.4°
C5C4H29108.2°109.5°
C4C3C2119.3°109.5°
C3C4H28108.2°109.4°
C3C4H29108.2°109.5°
C4C3H30107.0°109.5°
C4C3H31107.0°109.5°
C3C2C1115.2°109.5°
C2C3H30106.9°109.4°
C2C3H31107.0°109.5°
C3C2H32108.0°109.4°
C3C2H33108.0°109.5°
C2C1O1B116.6°120.0°
C2C1O1A117.5°120.0°
C1C2H32108.0°109.5°
C1C2H33108.0°109.5°
O1BC1O1A126.0°120.0°
C1O1AH34109.5°117.0°
H1C20H2109.4°109.5°
H1C20H3109.5°109.5°
H2C20H3109.5°109.4°
H4C19H5109.5°109.5°
H6C18H7109.5°109.4°
H8C17H9109.5°109.4°
H10C16H11109.4°109.5°
H19C10H20109.5°110.5°
H22C7H23109.4°109.4°
H24C6H25109.5°109.4°
H26C5H27109.5°109.5°
H28C4H29109.4°109.5°
H30C3H31109.5°109.4°
H32C2H33109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O15C15C16C1763.0°65.0°
O15C15C16C14117.5°120.0°
O15C15C16H12119.8°120.0°
O15C15C14H12118.7°120.0°
O15C15C14C13101.7°5.0°
O15C15C16H1057.7°175.0°
O15C15C16H11176.4°55.0°
O15C15C14H1478.3°175.0°
C17C18C19H6120.6°120.0°
C17C18C19H7120.6°120.0°
C17C18C19C20179.0°180.0°
C18C17C16H8120.5°120.1°
C18C17C16H9120.5°120.0°
C18C17C16C15158.2°180.0°
C17C18C19H460.5°60.0°
C17C18C19H558.5°60.1°
C17C18H6H7118.2°119.9°
C18C17H8H9118.4°120.0°
C18C17C16H1037.6°60.0°
C18C17C16H1181.1°60.1°
C18C19C20H4120.5°120.0°
C18C19C20H5120.5°120.0°
C19C18C17C1672.8°180.0°
C18C19C20H1180.0°60.0°
C18C19C20H260.0°60.0°
C18C19C20H360.0°180.0°
C18C19H4H5118.5°120.1°
C19C18H6H7118.2°120.1°
C19C18C17H847.8°60.0°
C19C18C17H9166.7°60.0°
C19C20H1H2120.0°120.0°
C19C20H1H3120.0°120.0°
C19C20H2H3120.0°120.0°
C20C19H4H5118.5°120.0°
C20C19C18H658.4°60.0°
C20C19C18H760.4°60.0°
C17C16C15H10120.7°120.0°
C17C16C15H11120.6°120.0°
C17C16C15C1454.6°175.0°
C16C17C18H647.8°60.0°
C16C17C18H7166.7°60.0°
C16C17H8H9118.4°119.9°
C17C16H10H11118.0°120.0°
C17C16C15H12177.2°55.0°
C16C15C14H12122.4°120.0°
C16C15C14C13139.4°125.0°
C15C16C17H881.2°60.0°
C15C16C17H937.7°60.0°
C15C16H10H11118.1°120.0°
C16C15O15H13180.0°59.9°
C16C15C14H1440.6°55.0°
C15C14C13H14180.0°180.0°
C15C14C13C12178.3°180.0°
C14C15C16H10175.2°55.1°
C14C15C16H1166.1°65.0°
C14C15O15H1357.1°60.0°
C15C14C13H151.7°0.0°
C14C13C12H15180.0°180.0°
C14C13C12C11122.3°125.6°
C14C13C12C8123.5°120.0°
C13C14C15H1217.0°115.0°
C14C13C12H161.5°2.8°
C13C12C11O1176.2°86.1°
C13C12C11C8121.3°118.6°
C13C12C11H16121.2°122.8°
C13C12C11C10164.1°155.7°
C13C12C8H16125.3°122.8°
C13C12C8C9149.7°141.7°
C13C12C8C786.5°99.0°
C12C13C14H141.7°0.0°
C13C12C11H1746.9°37.5°
C13C12C8H2136.2°22.3°
O11C11C12C10119.7°118.2°
O11C11C12H17123.0°123.6°
O11C11C10H17123.1°123.6°
O11C11C12C8162.5°155.3°
O11C11C10C9153.6°155.8°
O11C11C12H1645.0°36.7°
O11C11C10H1934.9°37.1°
O11C11C10H2087.7°85.4°
C12C11C10H17117.2°118.2°
C11C12C8H16117.7°118.7°
C11C12C8C932.7°23.1°
C11C12C8C7156.4°142.5°
C12C11C10C933.9°37.6°
C11C12C13H1557.7°54.4°
C12C11O11H18180.0°179.9°
C12C11C10H1984.8°81.1°
C12C11C10H20152.6°156.3°
C11C12C8H2180.9°96.3°
C10C11C12C842.8°37.1°
C11C10C9C813.3°23.8°
C11C10C9H19118.7°118.7°
C11C10C9H20118.7°118.7°
C11C10C9O9166.6°156.1°
C10C11C12H1674.7°81.5°
C10C11O11H1864.3°67.1°
C11C10H19H20123.8°122.5°
C12C8C9C7127.1°119.4°
C12C8C9H21113.4°119.4°
C12C8C7H21122.6°121.3°
C12C8C9C1012.1°0.3°
C12C8C9O9167.9°179.6°
C12C8C7C638.9°175.0°
C8C12C13H1556.6°60.0°
C8C12C11H1774.4°81.1°
C12C8C7H22160.1°54.9°
C12C8C7H2382.3°65.0°
C9C8C7H21119.6°121.3°
C8C9C10O9179.9°179.9°
C9C8C7C678.8°67.6°
C9C8C12H1685.0°95.5°
C8C9C10H19105.4°94.9°
C8C9C10H20132.0°142.5°
C9C8C7H2242.4°172.4°
C9C8C7H23160.0°52.4°
C7C8C9C10139.2°119.0°
C7C8C9O940.8°61.0°
C8C7C6H22121.2°120.0°
C8C7C6H23121.2°120.0°
C8C7C6C570.5°180.0°
C7C8C12H1638.8°23.8°
C8C7H22H23116.3°120.0°
C8C7C6H24168.7°59.9°
C8C7C6H2550.3°60.0°
C9C10C11H1783.3°80.6°
C9C10H19H20123.8°122.5°
C10C9C8H21101.2°119.7°
O9C9C10H1974.7°85.1°
O9C9C10H2048.0°37.4°
O9C9C8H2178.7°60.2°
C7C6C5H24120.8°119.9°
C7C6C5H25120.8°120.0°
C7C6C5C469.4°180.0°
C6C7C8H21161.6°53.7°
C6C7H22H23116.3°120.0°
C7C6H24H25117.5°119.9°
C7C6C5H26169.4°60.1°
C7C6C5H2751.8°60.0°
C6C5C4H26121.2°119.9°
C6C5C4H27121.2°120.1°
C6C5C4C3172.3°180.0°
C5C6C7H2250.7°60.0°
C5C6C7H23168.4°59.9°
C5C6H24H25117.4°120.1°
C6C5H26H27116.3°120.1°
C6C5C4H2866.9°60.1°
C6C5C4H2951.5°59.9°
C5C4C3H28120.8°119.9°
C5C4C3H29120.7°120.1°
C5C4C3C2137.5°180.0°
C4C5C6H2451.4°60.1°
C4C5C6H25169.8°59.9°
C4C5H26H27116.3°120.0°
C5C4H28H29117.7°120.0°
C5C4C3H30101.1°60.0°
C5C4C3H3116.1°59.9°
C4C3C2H30121.4°120.0°
C4C3C2H31121.4°120.1°
C4C3C2C129.4°180.0°
C3C4C5H2651.1°60.1°
C3C4C5H2766.5°59.9°
C3C4H28H29117.7°120.1°
C4C3H30H31115.6°120.0°
C4C3C2H32150.3°60.0°
C4C3C2H3391.5°59.9°
C3C2C1H32120.9°120.0°
C3C2C1H33120.9°120.0°
C3C2C1O1B117.2°0.0°
C3C2C1O1A63.7°180.0°
C2C3C4H2816.8°60.1°
C2C3C4H29101.7°60.0°
C2C3H30H31115.5°120.0°
C3C2H32H33117.4°120.0°
C2C1O1BO1A179.0°180.0°
C1C2C3H3092.0°60.0°
C1C2C3H31150.8°60.0°
C1C2H32H33117.4°120.0°
C2C1O1AH34179.0°180.0°
O1BC1C2H32121.9°120.0°
O1BC1C2H333.7°120.0°
O1BC1O1AH340.0°0.0°
O1AC1C2H3257.1°60.0°
O1AC1C2H33175.4°60.0°
H1C20H2H3120.0°120.0°
H1C20C19H459.5°60.0°
H1C20C19H559.5°180.0°
H2C20C19H4179.5°180.0°
H2C20C19H560.5°60.0°
H3C20C19H460.5°60.1°
H3C20C19H5179.5°60.0°
H4C19C18H6178.9°180.0°
H4C19C18H760.1°60.0°
H5C19C18H662.1°59.9°
H5C19C18H7179.1°180.0°
H6C18C17H8168.4°180.0°
H6C18C17H972.7°60.0°
H7C18C17H872.8°60.1°
H7C18C17H946.1°180.0°
H8C17C16H10158.1°179.9°
H8C17C16H1139.4°60.0°
H9C17C16H1083.0°60.0°
H9C17C16H11158.3°179.9°
H10C16C15H1262.1°65.0°
H11C16C15H1256.6°174.9°
H12C15O15H1361.0°180.0°
H12C15C14H14163.0°65.0°
H14C14C13H15178.3°180.0°
H15C13C12H16178.5°177.2°
H16C12C11H17168.0°160.2°
H16C12C8H21161.5°145.0°
H17C11O11H1857.9°56.5°
H17C11C10H19158.0°160.7°
H17C11C10H2035.3°38.2°
H21C8C7H2277.3°66.3°
H21C8C7H2340.4°173.7°
H22C7C6H2470.1°180.0°
H22C7C6H25171.5°60.1°
H23C7C6H2447.6°60.1°
H23C7C6H2570.8°180.0°
H24C6C5H2669.8°180.0°
H24C6C5H27172.6°60.0°
H25C6C5H2648.6°60.0°
H25C6C5H2769.1°180.0°
H26C5C4H28171.9°180.0°
H26C5C4H2969.6°60.0°
H27C5C4H2854.3°60.0°
H27C5C4H29172.7°180.0°
H28C4C3H30138.2°180.0°
H28C4C3H31104.6°60.0°
H29C4C3H3019.7°60.0°
H29C4C3H31136.9°180.0°
H30C3C2H3228.9°180.0°
H30C3C2H33147.1°60.1°
H31C3C2H3288.4°60.1°
H31C3C2H3329.9°180.0°

222036

PDB entries from 2024-07-03

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