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3W2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C30C27sing1.53Å1.54Å
C28C27sing1.53Å1.53Å
C27C29sing1.53Å1.54Å
C27N25sing1.47Å1.47Å
N24N25sing1.29Å1.30ÅAromatic
N24C23doub1.30Å1.30ÅAromatic
N25C26sing1.36Å1.37ÅAromatic
O10C9doub1.21Å1.22Å
C23C9sing1.47Å1.47Å
C23C22sing1.43Å1.44ÅAromatic
C26C22doub1.34Å1.34ÅAromatic
C9C8sing1.53Å1.53Å
C22O7sing1.36Å1.36Å
C8C1sing1.53Å1.54Å
O7C1sing1.43Å1.45Å
C1C2sing1.53Å1.55Å
C1C6sing1.53Å1.55Å
C2C3sing1.53Å1.54Å
C6C5sing1.53Å1.54Å
C3N4sing1.47Å1.48Å
C5N4sing1.47Å1.48Å
N4C11sing1.35Å1.37Å
C11C12sing1.47Å1.49Å
C11O13doub1.22Å1.22Å
C14C12doub1.38Å1.41ÅAromatic
C14C18sing1.41Å1.41ÅAromatic
C12C16sing1.41Å1.41ÅAromatic
C18C19doub1.39Å1.46ÅAromatic
C18C17sing1.47Å1.42ÅAromatic
C19N20sing1.34Å1.31ÅAromatic
C16C15doub1.35Å1.37ÅAromatic
C17C15sing1.41Å1.40ÅAromatic
C17N21doub1.32Å1.37ÅAromatic
N20N21sing1.40Å1.40ÅAromatic
C6H1sing1.09Å1.10Å
C6H2sing1.09Å1.10Å
C8H3sing1.09Å1.10Å
C8H4sing1.09Å1.10Å
C16H5sing1.08Å1.08Å
C19H6sing1.08Å1.08Å
C26H7sing1.08Å1.08Å
C2H8sing1.09Å1.10Å
C2H9sing1.09Å1.10Å
C3H10sing1.09Å1.10Å
C3H11sing1.09Å1.10Å
C5H12sing1.09Å1.10Å
C5H13sing1.09Å1.10Å
C14H14sing1.08Å1.08Å
C15H15sing1.08Å1.08Å
N20H16sing0.97Å1.00Å
C28H17sing1.09Å1.10Å
C28H18sing1.09Å1.10Å
C28H19sing1.09Å1.10Å
C29H20sing1.09Å1.10Å
C29H21sing1.09Å1.10Å
C29H22sing1.09Å1.10Å
C30H23sing1.09Å1.10Å
C30H24sing1.09Å1.10Å
C30H25sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C30C27C28109.3°109.5°
C30C27C29108.8°109.5°
C30C27N25108.3°109.5°
C27C30H23109.5°109.4°
C27C30H24109.5°109.5°
C27C30H25109.5°109.5°
C28C27C29111.7°109.5°
C28C27N25108.1°109.5°
C27C28H17109.5°109.5°
C27C28H18109.5°109.5°
C27C28H19109.4°109.5°
C29C27N25110.5°109.5°
C27C29H20109.5°109.5°
C27C29H21109.4°109.5°
C27C29H22109.5°109.5°
C27N25N24122.9°124.8°
C27N25C26126.5°124.8°
N25N24C23109.5°109.7°
N24N25C26110.6°110.3°
N24C23C9131.4°132.5°
N24C23C22107.6°107.5°
N25C26C22106.3°107.0°
N25C26H7126.8°126.5°
O10C9C23121.3°123.0°
O10C9C8122.6°123.0°
C9C23C22120.8°119.9°
C23C9C8116.1°114.0°
C23C22C26106.0°105.4°
C23C22O7121.5°122.2°
C26C22O7132.5°132.4°
C22C26H7126.9°126.5°
C9C8C1111.9°108.4°
C9C8H3108.9°109.6°
C9C8H4108.9°109.7°
C22O7C1118.4°116.2°
C8C1O7112.8°110.8°
C8C1C2107.9°109.2°
C8C1C6106.3°109.1°
C1C8H3108.9°109.7°
C1C8H4108.8°109.7°
O7C1C2109.2°109.1°
O7C1C6107.6°109.0°
C2C1C6113.2°109.4°
C1C2C3111.3°109.3°
C1C2H8109.0°109.5°
C1C2H9109.0°109.5°
C1C6C5113.7°109.3°
C1C6H1108.4°109.5°
C1C6H2108.4°109.5°
C2C3N4108.9°108.7°
C3C2H8109.0°109.4°
C3C2H9109.0°109.5°
C2C3H10109.6°109.6°
C2C3H11109.6°109.5°
C6C5N4109.1°108.7°
C5C6H1108.4°109.5°
C5C6H2108.4°109.5°
C6C5H12109.6°109.6°
C6C5H13109.6°109.6°
C3N4C5116.9°118.7°
C3N4C11121.3°120.7°
N4C3H10109.6°109.6°
N4C3H11109.6°109.6°
C5N4C11121.7°120.6°
N4C5H12109.5°109.6°
N4C5H13109.5°109.6°
N4C11C12121.2°120.0°
N4C11O13120.3°120.0°
C12C11O13118.6°120.0°
C11C12C14122.4°119.4°
C11C12C16117.7°119.4°
C12C14C18119.2°119.3°
C14C12C16119.7°121.2°
C12C14H14120.4°120.3°
C14C18C19134.5°134.6°
C14C18C17119.9°119.0°
C18C14H14120.4°120.3°
C12C16C15121.1°121.7°
C12C16H5119.5°119.1°
C19C18C17105.6°106.3°
C18C19N20107.9°107.8°
C18C19H6126.1°126.1°
C18C17C15119.3°118.9°
C18C17N21107.5°106.8°
C19N20N21110.8°110.0°
N20C19H6126.0°126.1°
C19N20H16124.6°125.0°
C16C15C17120.7°119.9°
C15C16H5119.5°119.2°
C16C15H15119.7°120.0°
C15C17N21133.2°134.4°
C17C15H15119.7°120.1°
C17N21N20108.2°109.0°
N21N20H16124.6°124.9°
H1C6H2109.5°109.5°
H3C8H4109.5°109.7°
H8C2H9109.5°109.5°
H10C3H11109.5°109.7°
H12C5H13109.5°109.8°
H17C28H18109.5°109.5°
H17C28H19109.5°109.5°
H18C28H19109.5°109.4°
H20C29H21109.5°109.5°
H20C29H22109.5°109.5°
H21C29H22109.5°109.5°
H23C30H24109.5°109.5°
H23C30H25109.5°109.5°
H24C30H25109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C30C27C28C29120.5°120.0°
C30C27C28N25117.7°120.0°
C30C27C29N25118.8°120.0°
C30C27N25N2464.8°15.0°
C30C27N25C26114.3°164.9°
C30C27C28H17180.0°60.0°
C30C27C28H1860.0°60.0°
C30C27C28H1960.0°179.9°
C30C27C29H20180.0°60.0°
C30C27C29H2160.0°60.0°
C30C27C29H2260.0°180.0°
C27C30H23H24120.0°120.0°
C27C30H23H25120.0°120.0°
C27C30H24H25120.0°120.0°
C28C27C29N25120.4°120.0°
C28C27N25N2453.5°134.9°
C28C27N25C26127.4°45.0°
C27C28H17H18120.0°120.0°
C27C28H17H19120.0°120.0°
C27C28H18H19120.0°120.0°
C28C27C29H2059.2°180.0°
C28C27C29H21179.2°60.0°
C28C27C29H2260.8°60.0°
C28C27C30H23180.0°180.0°
C28C27C30H2460.0°60.0°
C28C27C30H2560.0°60.0°
C29C27N25N24176.0°105.1°
C29C27N25C264.9°75.0°
C29C27C28H1759.5°60.0°
C29C27C28H1860.5°180.0°
C29C27C28H19179.5°60.0°
C27C29H20H21120.0°120.0°
C27C29H20H22120.0°120.0°
C27C29H21H22120.0°120.0°
C29C27C30H2357.8°60.0°
C29C27C30H24177.8°180.0°
C29C27C30H2562.2°60.0°
C27N25N24C26179.2°179.9°
C27N25N24C23177.2°179.9°
C27N25C26C22179.1°180.0°
C27N25C26H71.0°0.1°
N25C27C28H1762.3°180.0°
N25C27C28H18177.7°60.0°
N25C27C28H1957.7°60.0°
N25C27C29H2061.2°60.0°
N25C27C29H2158.8°180.0°
N25C27C29H22178.8°60.0°
N25C27C30H2362.4°60.0°
N25C27C30H2457.6°60.0°
N25C27C30H25177.5°180.0°
N25N24C23C9177.8°179.6°
N25N24C23C223.0°0.2°
N24N25C26C220.1°0.1°
N24N25C26H7179.8°180.0°
C23N24N25C262.0°0.2°
N24C23C9O100.1°12.1°
N24C23C9C22174.3°179.8°
N24C23C22C262.8°0.2°
N24C23C9C8178.5°167.9°
N24C23C22O7178.3°179.7°
N25C26C22C231.6°0.1°
N25C26C22H7180.0°179.9°
N25C26C22O7179.7°179.7°
O10C9C23C8178.6°179.9°
O10C9C23C22174.2°168.0°
O10C9C8C1152.3°139.3°
O10C9C8H331.9°19.6°
O10C9C8H487.4°100.9°
C9C23C22C26178.4°179.7°
C9C23C22O72.7°0.5°
C23C9C8C129.2°40.6°
C23C9C8H3149.6°160.3°
C23C9C8H491.2°79.1°
C23C22C26O7178.7°179.8°
C22C23C9C87.2°11.9°
C23C22O7C123.0°19.8°
C23C22C26H7178.4°179.9°
C26C22O7C1158.5°159.9°
C9C8C1H3120.4°119.7°
C9C8C1H4120.4°119.7°
C9C8C1O747.7°60.6°
C9C8C1C273.0°59.7°
C9C8C1C6165.3°179.3°
C9C8H3H4118.9°120.5°
C22O7C1C845.8°50.9°
C22O7C1C274.1°69.4°
C22O7C1C6162.7°171.1°
O7C22C26H70.3°0.3°
C8C1O7C2119.9°120.4°
C8C1O7C6116.9°120.2°
C8C1C2C6117.3°119.4°
C8C1C2C3166.8°179.2°
C8C1C6C5165.3°179.1°
C8C1C6H144.7°61.0°
C8C1C6H274.1°59.1°
C1C8H3H4118.9°120.6°
C8C1C2H872.9°59.3°
C8C1C2H946.6°60.8°
O7C1C2C6119.8°119.2°
O7C1C2C370.3°57.8°
O7C1C6C573.7°57.9°
O7C1C6H1165.7°177.8°
O7C1C6H247.0°62.1°
O7C1C8H3168.1°179.7°
O7C1C8H472.7°59.1°
O7C1C2H850.0°62.0°
O7C1C2H9169.5°177.9°
C1C2C3H8120.3°119.9°
C1C2C3H9120.3°120.0°
C2C1C6C547.1°61.4°
C1C2C3N453.6°54.7°
C2C1C6H173.6°58.5°
C2C1C6H2167.7°178.6°
C2C1C8H347.4°60.0°
C2C1C8H4166.6°179.4°
C1C2H8H9119.2°120.1°
C1C2C3H1066.3°65.1°
C1C2C3H11173.5°174.4°
C6C1C2C349.5°61.4°
C1C6C5H1120.6°119.9°
C1C6C5H2120.6°120.0°
C1C6C5N447.8°54.7°
C1C6H1H2118.1°120.1°
C6C1C8H374.3°59.6°
C6C1C8H445.0°61.0°
C6C1C2H8169.8°178.7°
C6C1C2H970.7°58.6°
C1C6C5H12167.8°174.5°
C1C6C5H1372.1°65.0°
C2C3N4H10119.9°119.9°
C2C3N4H11119.9°119.7°
C2C3N4C560.1°53.7°
C2C3N4C11120.5°126.4°
C3C2H8H9119.2°120.1°
C2C3H10H11120.3°120.4°
C6C5N4C356.5°53.7°
C6C5N4H12120.0°119.7°
C6C5N4H13120.0°119.7°
C6C5N4C11124.0°126.4°
C5C6H1H2118.1°120.1°
C6C5H12H13120.2°120.3°
C3N4C5C11179.4°180.0°
C3N4C11C120.6°176.3°
C3N4C11O13179.1°3.8°
N4C3C2H8173.9°174.6°
N4C3C2H966.7°65.3°
N4C3H10H11120.2°120.3°
C3N4C5H12176.5°173.4°
C3N4C5H1363.4°66.1°
C5N4C11C12180.0°3.8°
C5N4C11O131.5°176.2°
N4C5C6H172.8°65.2°
N4C5C6H2168.4°174.7°
C5N4C3H1059.8°66.2°
C5N4C3H11180.0°173.4°
N4C5H12H13120.1°120.4°
N4C11C12O13178.5°179.9°
N4C11C12C1457.3°51.4°
N4C11C12C16117.9°128.6°
C11N4C3H10119.6°113.8°
C11N4C3H110.6°6.7°
C11N4C5H124.1°6.6°
C11N4C5H13116.0°113.9°
C11C12C14C16175.1°179.9°
C11C12C14C18176.3°180.0°
C11C12C16C15173.5°179.6°
C11C12C16H56.5°0.4°
C11C12C14H143.8°0.0°
O13C11C12C14124.2°128.5°
O13C11C12C1660.6°51.4°
C12C14C18H14180.0°179.9°
C12C14C18C19177.6°180.0°
C12C14C18C172.2°0.3°
C14C12C16C151.9°0.3°
C14C12C16H5178.1°179.7°
C18C14C12C161.1°0.1°
C14C18C19C17179.9°179.7°
C14C18C19N20178.8°179.7°
C14C18C17C150.4°0.2°
C14C18C17N21178.5°179.7°
C14C18C19H61.2°0.3°
C12C16C15H5180.0°180.0°
C12C16C15C173.8°0.4°
C16C12C14H14178.9°179.9°
C12C16C15H15176.2°179.9°
C18C19N20H6180.0°179.9°
C19C18C17C15179.5°179.9°
C19C18C17N211.3°0.0°
C18C19N20N210.4°0.0°
C19C18C14H142.4°0.0°
C18C19N20H16179.6°180.0°
C17C18C19N201.1°0.0°
C18C17C15C162.6°0.2°
C18C17C15N21177.6°179.9°
C18C17N21N201.1°0.0°
C17C18C19H6178.9°179.9°
C17C18C14H14177.8°179.7°
C18C17C15H15177.4°179.8°
C19N20N21C170.5°0.1°
C19N20N21H16180.0°179.9°
C16C15C17H15180.0°179.6°
C16C15C17N21175.0°179.9°
C15C17N21N20178.9°179.9°
C17C15C16H5176.2°179.5°
N21C17C15H155.1°0.3°
C17N21N20H16179.5°180.0°
N21N20C19H6179.6°180.0°
H1C6C5H1247.1°54.6°
H1C6C5H13167.3°175.0°
H2C6C5H1271.6°65.5°
H2C6C5H1348.5°54.9°
H5C16C15H153.8°0.1°
H6C19N20H160.4°0.1°
H8C2C3H1053.9°54.8°
H8C2C3H1166.3°65.6°
H9C2C3H10173.4°174.9°
H9C2C3H1153.2°54.4°
H17C28H18H19120.0°120.0°
H20C29H21H22120.0°120.0°
H23C30H24H25120.0°120.0°

227344

PDB entries from 2024-11-13

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