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85V

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C28C27sing1.53Å1.49Å
C28C26sing1.53Å1.51Å
C5C4doub1.38Å1.38ÅAromatic
C5C6sing1.39Å1.39ÅAromatic
C4C3sing1.38Å1.39ÅAromatic
C18C17sing1.54Å1.52Å
C18O19sing1.45Å1.43Å
C14O16sing1.35Å1.33Å
C14N13sing1.36Å1.31ÅAromatic
C14N15doub1.31Å1.35ÅAromatic
O16C17sing1.43Å1.46Å
N13C10sing1.38Å1.39ÅAromatic
C17C21sing1.54Å1.53Å
N15C9sing1.36Å1.39ÅAromatic
C9C10doub1.41Å1.40ÅAromatic
C9C8sing1.40Å1.39ÅAromatic
C10C11sing1.39Å1.39ÅAromatic
C8C7doub1.39Å1.40ÅAromatic
C11C12doub1.38Å1.38ÅAromatic
C7C12sing1.40Å1.42ÅAromatic
C7C6sing1.48Å1.49Å
C12CLsing1.74Å1.73Å
C27C26sing1.53Å1.51Å
C6C1doub1.39Å1.40ÅAromatic
C3C26sing1.51Å1.53Å
C3C2doub1.38Å1.39ÅAromatic
C26C29sing1.53Å1.53Å
O19C20sing1.44Å1.43Å
C1C2sing1.38Å1.39ÅAromatic
C29O30sing1.43Å1.42Å
C21C20sing1.56Å1.53Å
C21O22sing1.44Å1.43Å
C20C24sing1.54Å1.53Å
O22C23sing1.44Å1.44Å
C23C24sing1.54Å1.51Å
C24O25sing1.43Å1.43Å
C4H1sing1.08Å1.08Å
C20H2sing1.09Å1.10Å
C21H3sing1.09Å1.10Å
C8H4sing1.08Å1.08Å
C18H5sing1.09Å1.10Å
C18H6sing1.09Å1.10Å
C1H7sing1.08Å1.08Å
C2H8sing1.08Å1.08Å
C5H9sing1.08Å1.08Å
C11H10sing1.08Å1.08Å
N13H11sing0.97Å1.00Å
C17H13sing1.09Å1.10Å
C23H14sing1.09Å1.10Å
C23H15sing1.09Å1.10Å
C24H16sing1.09Å1.10Å
O25H17sing0.97Å0.95Å
C27H18sing1.09Å1.10Å
C27H19sing1.09Å1.10Å
C28H20sing1.09Å1.10Å
C28H21sing1.09Å1.10Å
C29H22sing1.09Å1.10Å
C29H23sing1.09Å1.10Å
O30H24sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C27C28C2660.4°60.0°
C28C27C2660.5°60.0°
C28C27H18119.9°117.5°
C28C27H19119.9°117.5°
C27C28H20119.9°117.5°
C27C28H21120.0°117.4°
C28C26C2759.1°60.1°
C28C26C3117.8°117.5°
C28C26C29116.7°117.5°
C26C28H20119.9°117.5°
C26C28H21120.0°117.5°
C4C5C6121.2°119.9°
C5C4C3121.2°120.1°
C5C4H1119.4°120.0°
C4C5H9119.4°120.0°
C5C6C7120.9°120.1°
C5C6C1117.6°119.8°
C6C5H9119.4°120.1°
C4C3C26120.5°119.9°
C4C3C2117.9°120.2°
C3C4H1119.4°119.9°
C17C18O19102.9°105.2°
C18C17O16105.3°110.5°
C18C17C21102.4°104.2°
C17C18H5111.1°110.3°
C17C18H6111.1°110.4°
C18C17H13112.1°110.4°
C18O19C20104.6°105.2°
O19C18H5111.1°110.2°
O19C18H6111.1°110.2°
O16C14N13124.3°125.0°
O16C14N15120.2°125.0°
C14O16C17123.5°117.0°
N13C14N15115.5°110.0°
C14N13C10103.6°107.3°
C14N13H11128.2°126.4°
C14N15C9105.0°109.6°
O16C17C21111.4°110.2°
O16C17H13113.1°110.5°
N13C10C9110.0°106.0°
N13C10C11130.1°133.8°
C10N13H11128.2°126.3°
C17C21C20103.8°104.0°
C17C21O22113.3°108.7°
C17C21H3110.4°113.2°
C21C17H13111.9°110.9°
N15C9C10105.8°107.0°
N15C9C8132.6°133.3°
C10C9C8121.6°119.6°
C9C10C11119.9°120.2°
C9C8C7119.3°119.7°
C9C8H4120.3°120.2°
C10C11C12118.8°120.0°
C10C11H10120.6°120.0°
C8C7C12118.3°120.3°
C8C7C6118.2°119.8°
C7C8H4120.3°120.2°
C11C12C7122.1°120.3°
C11C12CL117.3°119.9°
C12C11H10120.6°120.0°
C12C7C6123.5°119.9°
C7C12CL120.6°119.9°
C7C6C1121.5°120.1°
C27C26C3119.1°117.5°
C27C26C29116.7°117.5°
C26C27H18119.9°117.5°
C26C27H19119.9°117.5°
C6C1C2121.1°119.9°
C6C1H7119.4°120.1°
C26C3C2121.6°119.9°
C3C26C29115.8°115.5°
C3C2C1121.0°120.1°
C3C2H8119.5°119.9°
C26C29O30110.8°109.5°
C26C29H22109.2°109.5°
C26C29H23109.2°109.5°
O19C20C21105.6°105.3°
O19C20C24113.0°108.7°
O19C20H2112.0°112.7°
C2C1H7119.4°120.0°
C1C2H8119.5°120.0°
O30C29H22109.1°109.5°
O30C29H23109.1°109.5°
C29O30H24109.5°114.0°
C20C21O22106.5°104.7°
C21C20C24105.0°103.9°
C21C20H2110.5°112.9°
C20C21H3110.4°112.9°
C21O22C23108.6°105.6°
O22C21H3111.9°112.7°
C20C24C23101.1°104.3°
C20C24O25113.9°110.5°
C24C20H2110.5°112.7°
C20C24H16108.9°110.5°
O22C23C24105.5°104.8°
O22C23H14110.4°110.4°
O22C23H15110.5°110.4°
C23C24O25113.2°110.5°
C24C23H14110.4°110.3°
C24C23H15110.4°110.4°
C23C24H16109.1°110.5°
O25C24H16110.3°110.5°
C24O25H17109.5°114.0°
H5C18H6109.5°110.4°
H14C23H15109.5°110.5°
H18C27H19109.4°115.6°
H20C28H21109.5°115.6°
H22C29H23109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C27C28C26H20109.6°107.5°
C27C28C26H21109.6°107.4°
C28C27C26H18109.6°107.5°
C28C27C26H19109.6°107.5°
C28C27C26C3106.8°107.6°
C27C28C26C29106.5°107.6°
C28C27H18H19144.4°145.7°
C27C28H20H21144.6°145.7°
C28C26C3C453.2°31.5°
C28C26C3C29144.8°145.6°
C28C26C3C2124.3°148.4°
C28C26C29O30131.0°80.5°
C26C28H20H21144.5°145.7°
C28C26C29H22108.8°39.5°
C28C26C29H2310.8°159.5°
C4C5C6H9180.0°179.9°
C5C4C3H1180.0°179.8°
C4C5C6C7178.3°180.0°
C4C5C6C10.2°0.1°
C5C4C3C26176.9°179.7°
C5C4C3C20.7°0.2°
C6C5C4C30.3°0.1°
C5C6C7C843.6°49.8°
C5C6C7C12135.3°130.0°
C5C6C7C1178.0°179.9°
C5C6C1C20.4°0.3°
C6C5C4H1179.6°179.7°
C5C6C1H7179.6°180.0°
C4C3C26C27121.4°100.2°
C4C3C26C2177.5°179.9°
C4C3C26C2991.6°114.1°
C4C3C2C10.5°0.5°
C4C3C2H8179.5°180.0°
C3C4C5H9179.6°180.0°
C17C18O19H5118.9°118.9°
C17C18O19H6118.9°119.0°
C18C17O16C14169.5°91.5°
C18C17O16C21110.2°114.6°
C18C17O16H13122.7°122.5°
C18C17C21H13120.2°118.8°
C17C18O19C2046.8°39.8°
C18C17C21C2015.4°0.9°
C18C17C21O22130.6°112.1°
C18C17C21H3102.9°121.9°
C17C18H5H6123.1°122.3°
O19C18C17O1678.9°94.2°
O19C18C17C2137.7°24.1°
C18O19C20C2136.6°39.1°
C18O19C20C24150.7°150.0°
C18O19C20H283.7°84.4°
O19C18H5H6123.1°122.0°
O19C18C17H13157.7°143.3°
O16C14N13N15178.5°179.8°
O16C14N13C10177.7°180.0°
C14O16C17C2180.3°153.9°
O16C14N15C9178.1°179.8°
O16C14N13H112.4°0.1°
C14O16C17H1346.8°31.0°
N13C14O16C17178.6°180.0°
C14N13C10H11180.0°179.9°
N13C14N15C90.4°0.4°
C14N13C10C90.9°0.0°
C14N13C10C11176.6°179.7°
N15C14O16C170.2°0.3°
N15C14N13C100.9°0.2°
C14N15C9C100.2°0.4°
C14N15C9C8177.8°179.9°
N15C14N13H11179.1°179.7°
O16C17C21H13127.7°122.6°
O16C17C21C2096.7°117.6°
O16C17C21O2218.5°6.5°
O16C17C21H3145.0°119.5°
O16C17C18H540.0°24.7°
O16C17C18H6162.1°147.0°
N13C10C9N150.7°0.2°
N13C10C9C11177.8°179.7°
N13C10C9C8178.6°180.0°
N13C10C11C12177.2°179.8°
N13C10C11H102.8°0.3°
C17C21C20O1911.7°22.7°
C17C21C20O22119.9°114.0°
C17C21C20H3118.3°123.1°
C17C21O22H3125.6°126.3°
C17C21C20C24131.3°137.0°
C17C21O22C23101.6°150.6°
C17C21C20H2109.5°100.6°
C21C17C18H5156.6°143.0°
C21C17C18H681.3°94.7°
N15C9C10C8177.9°179.8°
N15C9C10C11177.1°180.0°
N15C9C8C7176.2°179.7°
N15C9C8H43.7°0.4°
C10C9C8C71.1°0.0°
C9C10C11C120.1°0.5°
C10C9C8H4179.0°179.9°
C9C10C11H10179.9°180.0°
C9C10N13H11179.0°179.9°
C8C9C10C110.8°0.2°
C9C8C7H4180.0°179.9°
C9C8C7C120.4°0.0°
C9C8C7C6179.3°179.7°
C10C11C12H10180.0°179.5°
C10C11C12C70.8°0.5°
C10C11C12CL178.8°179.5°
C11C10N13H113.4°0.4°
C8C7C12C110.6°0.2°
C8C7C12C6178.9°179.8°
C8C7C12CL179.0°179.7°
C8C7C6C1134.4°130.3°
C11C12C7CL179.6°180.0°
C11C12C7C6178.3°180.0°
C12C7C6C146.8°50.0°
C12C7C8H4179.6°179.9°
C7C12C11H10179.2°180.0°
C6C7C12CL2.1°0.0°
C7C6C1C2178.5°179.7°
C6C7C8H40.7°0.3°
C7C6C1H71.5°0.1°
C7C6C5H91.7°0.1°
CLC12C11H101.2°0.1°
C27C26C3C29147.0°145.7°
C27C26C3C256.1°79.7°
C27C26C29O3064.0°149.2°
C26C27H18H19144.5°145.6°
C27C26C29H22175.8°29.2°
C27C26C29H2356.2°90.8°
C6C1C2C30.0°0.5°
C6C1C2H7180.0°179.7°
C6C1C2H8180.0°180.0°
C1C6C5H9179.8°179.9°
C26C3C2C1177.1°179.4°
C3C26C29O3083.8°65.1°
C26C3C4H13.1°0.1°
C26C3C2H82.9°0.1°
C3C26C27H18143.6°0.0°
C3C26C27H192.8°145.0°
C3C26C28H200.6°145.0°
C3C26C28H21141.4°0.1°
C3C26C29H2236.4°174.9°
C3C26C29H23156.0°54.9°
C2C3C26C2990.9°66.0°
C3C2C1H8180.0°179.4°
C2C3C4H1179.3°180.0°
C3C2C1H7180.0°179.7°
C26C29O30H22120.2°120.0°
C26C29O30H23120.2°120.1°
C29C26C27H183.1°145.0°
C29C26C27H19143.9°0.0°
C29C26C28H20143.9°0.1°
C29C26C28H213.1°145.0°
C26C29H22H23119.4°120.0°
C26C29O30H24180.0°179.9°
O19C20C21C24119.6°114.3°
O19C20C21H2121.3°123.3°
O19C20C21O22108.2°91.3°
O19C20C24H2126.3°125.7°
O19C20C24C2385.9°112.7°
O19C20C24O2535.8°6.0°
O19C20C21H3130.0°145.8°
C20O19C18H5165.7°158.7°
C20O19C18H672.1°79.2°
O19C20C24H16159.3°128.5°
O30C29H22H23119.4°120.0°
C20C21O22H3120.8°123.0°
C21C20C24H2119.1°122.5°
C20C21O22C2311.9°39.9°
C21C20C24C2328.7°0.9°
C21C20C24O25150.4°117.8°
C20C21C17H13135.7°119.8°
C21C20C24H1686.1°119.7°
O22C21C20C2411.4°23.0°
C21O22C23C2431.1°40.6°
O22C21C20H2130.5°145.4°
O22C21C17H13109.2°129.1°
C21O22C23H14150.5°78.2°
C21O22C23H1588.2°159.4°
C20C24C23O2236.5°24.5°
C20C24C23O25122.2°118.7°
C20C24C23H16114.7°118.7°
C20C24O25H16122.7°122.5°
C24C20C21H3110.4°99.9°
C20C24C23H14155.8°94.3°
C20C24C23H1582.9°143.3°
C20C24O25H17180.0°180.0°
O22C23C24H14119.4°118.8°
O22C23C24H15119.4°118.8°
O22C23C24O25158.7°94.2°
C23O22C21H3132.8°83.1°
O22C23H14H15121.9°122.4°
O22C23C24H1678.2°143.2°
C23C24O25H16122.5°122.6°
C23C24C20H2147.8°121.6°
C24C23H14H15121.8°122.3°
C23C24O25H1765.3°65.1°
O25C24C20H290.5°119.7°
O25C24C23H1482.0°147.0°
O25C24C23H1539.3°24.6°
H1C4C5H90.4°0.2°
H2C20C21H38.8°22.5°
H2C20C24H1633.0°2.9°
H3C21C17H1317.3°3.1°
H5C18C17H1383.4°97.8°
H6C18C17H1338.8°24.5°
H7C1C2H80.0°0.3°
H14C23C24H1641.2°24.4°
H15C23C24H16162.4°98.0°
H16C24O25H1757.2°57.5°
H18C27C28H20140.8°145.0°
H18C27C28H210.1°0.0°
H19C27C28H200.1°0.1°
H19C27C28H21140.8°145.1°
H22C29O30H2459.8°60.1°
H23C29O30H2459.8°59.9°

222624

PDB entries from 2024-07-17

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