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9J4

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N21C17sing1.47Å1.48Å
C22C16sing1.53Å1.54Å
C28C17sing1.53Å1.52Å
C20C16sing1.53Å1.55Å
C17C16sing1.54Å1.59Å
C17C18sing1.55Å1.54Å
C16C15sing1.54Å1.53Å
C18C19sing1.55Å1.54Å
C15N10sing1.47Å1.45Å
C15C19sing1.54Å1.53Å
O13C11doub1.22Å1.24Å
N10C6sing1.38Å1.33Å
C11C5sing1.47Å1.50Å
C11N12sing1.35Å1.33Å
C6C5doub1.40Å1.41ÅAromatic
C6C1sing1.41Å1.44ÅAromatic
C27C26doub1.38Å1.39ÅAromatic
C27C14sing1.39Å1.39ÅAromatic
C5C4sing1.41Å1.42ÅAromatic
C26C25sing1.38Å1.38ÅAromatic
C7C1doub1.38Å1.40ÅAromatic
C7C8sing1.40Å1.45ÅAromatic
C1N2sing1.38Å1.39ÅAromatic
C4N3doub1.30Å1.29ÅAromatic
C8C14sing1.48Å1.49Å
C8C9doub1.38Å1.37ÅAromatic
N2N3sing1.40Å1.37ÅAromatic
N2C9sing1.35Å1.36ÅAromatic
C14C23doub1.39Å1.40ÅAromatic
C25C24doub1.38Å1.38ÅAromatic
C23C24sing1.38Å1.39ÅAromatic
C18H1sing1.09Å1.10Å
C18H2sing1.09Å1.10Å
C15H3sing1.09Å1.10Å
C19H4sing1.09Å1.10Å
C19H5sing1.09Å1.10Å
C20H6sing1.09Å1.10Å
C20H7sing1.09Å1.10Å
C20H8sing1.09Å1.10Å
C22H9sing1.09Å1.10Å
C22H10sing1.09Å1.10Å
C22H11sing1.09Å1.10Å
C23H12sing1.08Å1.08Å
C24H13sing1.08Å1.08Å
C27H14sing1.08Å1.08Å
C4H15sing1.08Å1.08Å
C7H16sing1.08Å1.08Å
C9H17sing1.08Å1.08Å
N10H18sing0.97Å1.00Å
N12H19sing0.97Å1.00Å
N12H20sing0.97Å1.00Å
N21H21sing1.01Å1.00Å
N21H22sing1.01Å1.00Å
C25H24sing1.08Å1.08Å
C26H25sing1.08Å1.08Å
C28H26sing1.09Å1.10Å
C28H27sing1.09Å1.10Å
C28H28sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N21C17C28104.6°110.5°
N21C17C16113.6°110.5°
N21C17C18107.7°110.5°
C17N21H21109.5°111.0°
C17N21H22109.5°111.0°
C22C16C20105.5°110.0°
C22C16C17113.2°110.0°
C22C16C15111.2°110.0°
C16C22H9109.5°109.5°
C16C22H10109.5°109.5°
C16C22H11109.5°109.5°
C28C17C16116.3°110.5°
C28C17C18111.2°110.5°
C17C28H26109.5°109.5°
C17C28H27109.4°109.5°
C17C28H28109.4°109.4°
C20C16C17115.6°110.0°
C20C16C15115.8°110.0°
C16C20H6109.5°109.5°
C16C20H7109.5°109.5°
C16C20H8109.5°109.5°
C16C17C18103.4°104.2°
C17C16C1595.7°106.6°
C17C18C19104.5°102.7°
C17C18H1110.7°110.8°
C17C18H2110.7°111.0°
C16C15N10115.9°110.0°
C16C15C19104.8°106.6°
C16C15H3108.0°110.1°
C18C19C15104.7°104.2°
C19C18H1110.7°110.7°
C19C18H2110.7°110.7°
C18C19H4110.6°110.6°
C18C19H5110.7°110.5°
N10C15C19110.7°110.0°
C15N10C6128.9°120.0°
N10C15H3109.0°110.0°
C15N10H18104.4°120.0°
C19C15H3108.0°110.0°
C15C19H4110.7°110.5°
C15C19H5110.6°110.5°
O13C11C5121.5°120.0°
O13C11N12120.4°120.0°
N10C6C5120.3°120.7°
N10C6C1122.6°120.7°
C6N10H18104.4°120.0°
C5C11N12118.0°120.0°
C11C5C6121.9°120.3°
C11C5C4120.4°120.3°
C11N12H19120.0°120.0°
C11N12H20120.0°120.0°
C5C6C1117.0°118.6°
C6C5C4117.7°119.4°
C6C1C7137.2°132.3°
C6C1N2117.1°119.5°
C26C27C14120.6°119.9°
C27C26C25120.3°120.1°
C26C27H14119.7°120.0°
C27C26H25119.8°119.9°
C27C14C8121.0°120.1°
C27C14C23118.4°119.8°
C14C27H14119.7°120.1°
C5C4N3127.9°121.1°
C5C4H15116.0°119.5°
C26C25C24119.7°120.2°
C26C25H24120.1°119.9°
C25C26H25119.8°120.0°
C1C7C8107.3°106.9°
C7C1N2105.7°108.2°
C1C7H16126.3°126.6°
C7C8C14129.5°126.4°
C7C8C9107.6°107.4°
C8C7H16126.4°126.5°
C1N2N3126.8°119.9°
C1N2C9111.7°108.7°
C4N3N2113.5°121.5°
N3C4H15116.0°119.4°
C14C8C9122.9°126.3°
C8C14C23120.5°120.1°
C8C9N2107.7°108.9°
C8C9H17126.2°125.5°
N3N2C9121.5°131.4°
N2C9H17126.2°125.6°
C14C23C24120.7°119.9°
C14C23H12119.6°120.1°
C25C24C23120.3°120.1°
C25C24H13119.8°119.9°
C24C25H24120.2°119.9°
C24C23H12119.6°120.1°
C23C24H13119.9°119.9°
H1C18H2109.4°110.7°
H4C19H5109.5°110.5°
H6C20H7109.5°109.5°
H6C20H8109.5°109.4°
H7C20H8109.5°109.4°
H9C22H10109.5°109.5°
H9C22H11109.5°109.5°
H10C22H11109.4°109.4°
H19N12H20120.0°120.0°
H21N21H22109.5°111.0°
H26C28H27109.4°109.5°
H26C28H28109.5°109.5°
H27C28H28109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N21C17C16C2280.0°145.6°
N21C17C28C16126.1°122.6°
N21C17C28C18116.0°122.6°
N21C17C16C2041.8°24.2°
N21C17C16C18116.4°118.7°
N21C17C16C15164.0°95.1°
N21C17C18C19150.1°80.8°
N21C17C18H190.7°160.9°
N21C17C18H230.9°37.6°
C17N21H21H22120.0°123.9°
N21C17C28H26180.0°62.7°
N21C17C28H2760.0°57.4°
N21C17C28H2860.0°177.4°
C22C16C17C2841.4°23.0°
C22C16C20C17125.9°121.4°
C22C16C20C15123.4°121.4°
C22C16C17C15115.9°119.3°
C22C16C17C18163.6°95.7°
C22C16C15N1071.1°121.4°
C22C16C15C19166.5°119.3°
C22C16C15H351.5°0.0°
C22C16C20H6180.0°61.4°
C22C16C20H760.0°58.6°
C22C16C20H860.0°178.6°
C16C22H9H10120.0°120.0°
C16C22H9H11120.0°120.0°
C16C22H10H11120.0°119.9°
C28C17C16C20163.2°98.4°
C28C17C16C18122.1°118.7°
C28C17C16C1574.5°142.3°
C28C17C18C1995.9°156.6°
C28C17C18H123.3°38.3°
C28C17C18H2144.9°85.0°
C28C17N21H21180.0°57.4°
C28C17N21H2260.0°66.6°
C17C28H26H27120.0°120.1°
C17C28H26H28120.0°119.9°
C17C28H27H28120.0°119.9°
C20C16C17C15122.2°119.3°
C20C16C17C1874.6°142.9°
C20C16C15N1049.2°0.1°
C20C16C15C1973.1°119.3°
C20C16C15H3171.9°121.4°
C16C20H6H7120.0°120.1°
C16C20H6H8120.0°120.0°
C16C20H7H8120.0°120.0°
C20C16C22H9180.0°178.6°
C20C16C22H1060.0°58.6°
C20C16C22H1160.0°61.4°
C16C17C18C1929.6°37.9°
C17C16C15N10171.3°119.3°
C17C16C15C1948.9°0.0°
C16C17C18H1148.8°80.4°
C16C17C18H289.6°156.3°
C17C16C15H366.1°119.3°
C17C16C20H654.1°60.0°
C17C16C20H765.9°180.0°
C17C16C20H8174.1°60.0°
C17C16C22H952.7°60.0°
C17C16C22H10172.7°180.0°
C17C16C22H1167.3°60.0°
C16C17N21H2152.3°180.0°
C16C17N21H22172.3°56.0°
C16C17C28H2653.9°60.0°
C16C17C28H2766.1°180.0°
C16C17C28H28173.9°60.0°
C18C17C16C1547.6°23.6°
C17C18C19H1119.2°118.3°
C17C18C19H2119.2°118.5°
C17C18C19C151.0°37.9°
C17C18H1H2122.3°123.5°
C17C18C19H4120.3°156.6°
C17C18C19H5118.2°80.7°
C18C17N21H2161.6°65.2°
C18C17N21H2258.4°170.8°
C18C17C28H2664.1°174.8°
C18C17C28H27176.0°65.2°
C18C17C28H2856.0°54.8°
C16C15C19C1832.8°23.6°
C16C15N10C19119.2°117.1°
C16C15N10H3122.1°121.5°
C16C15C19H3115.0°119.3°
C16C15N10C6109.1°149.8°
C16C15C19H4152.0°142.3°
C16C15C19H586.5°95.1°
C15C16C20H656.6°177.2°
C15C16C20H7176.6°62.7°
C15C16C20H863.4°57.2°
C15C16C22H953.7°57.2°
C15C16C22H1066.3°62.8°
C15C16C22H11173.7°177.2°
C16C15N10H18128.4°30.3°
C18C19C15N10158.5°142.9°
C18C19C15H4119.3°118.7°
C18C19C15H5119.3°118.7°
C19C18H1H2122.3°123.2°
C18C19C15H382.2°95.7°
C18C19H4H5122.2°122.6°
N10C15C19H3119.3°121.4°
C15N10C6H18122.6°180.0°
C15N10C6C5155.6°122.3°
C15N10C6C128.4°57.8°
N10C15C19H482.3°98.4°
N10C15C19H539.2°24.2°
C19C15N10C6131.7°93.1°
C15C19C18H1118.2°80.4°
C15C19C18H2120.3°156.4°
C15C19H4H5122.2°122.6°
C19C15N10H189.2°86.9°
O13C11C5N12179.8°179.9°
O13C11C5C614.4°5.4°
O13C11C5C4167.2°174.6°
O13C11N12H190.0°180.0°
O13C11N12H20180.0°0.1°
N10C6C5C112.6°0.0°
N10C6C5C1176.2°179.9°
N10C6C5C4175.8°180.0°
N10C6C1C75.9°0.3°
N10C6C1N2176.6°180.0°
C6N10C15H313.0°28.3°
C11C5C6C4178.4°180.0°
C11C5C6C1178.8°179.9°
C11C5C4N3179.3°180.0°
C11C5C4H150.7°0.1°
C5C11N12H19179.8°0.0°
C5C11N12H200.2°180.0°
N12C11C5C6165.3°174.6°
N12C11C5C413.0°5.5°
C11N12H19H20180.0°180.0°
C5C6C1C7178.0°179.8°
C5C6C1N20.5°0.1°
C6C5C4N30.9°0.0°
C6C5C4H15179.1°179.9°
C5C6N10H1881.8°57.7°
C1C6C5C40.4°0.1°
C6C1C7N2177.8°179.7°
C6C1C7C8177.4°179.7°
C6C1N2N31.0°0.1°
C6C1N2C9177.4°180.0°
C6C1C7H162.6°0.3°
C1C6N10H1894.2°122.2°
C26C27C14H14180.0°179.2°
C27C26C25H25180.0°179.3°
C26C27C14C8175.3°179.5°
C26C27C14C230.7°0.5°
C27C26C25C240.5°0.5°
C27C26C25H24179.5°179.5°
C14C27C26C250.8°0.7°
C27C14C8C729.6°180.0°
C27C14C8C23175.9°180.0°
C27C14C8C9153.2°0.2°
C27C14C23C240.2°0.0°
C27C14C23H12179.9°179.7°
C14C27C26H25179.2°180.0°
C5C4N3H15180.0°179.9°
C5C4N3N20.4°0.0°
C26C25C24H24180.0°180.0°
C26C25C24C230.0°0.0°
C26C25C24H13180.0°180.0°
C25C26C27H14179.2°180.0°
C1C7C8H16180.0°180.0°
C1C7C8C14177.4°180.0°
C1C7C8C90.2°0.2°
C7C1N2N3179.3°179.8°
C7C1N2C90.9°0.2°
C8C7C1N20.4°0.0°
C7C8C14C9177.3°179.8°
C7C8C9N20.7°0.3°
C7C8C14C23154.6°0.0°
C7C8C9H17179.3°179.9°
C1N2N3C40.6°0.0°
C1N2C9C81.0°0.4°
C1N2N3C9178.3°179.9°
N2C1C7H16179.6°180.0°
C1N2C9H17179.0°180.0°
C4N3N2C9177.7°180.0°
C14C8C9N2177.1°179.8°
C8C14C23C24175.8°180.0°
C8C14C23H124.2°0.3°
C8C14C27H144.7°0.3°
C14C8C7H162.6°0.1°
C14C8C9H172.9°0.2°
C8C9N2N3179.6°179.7°
C8C9N2H17180.0°179.6°
C9C8C14C2322.7°179.8°
C9C8C7H16179.8°179.8°
N2N3C4H15179.6°179.9°
N3N2C9H170.5°0.1°
C14C23C24C250.2°0.2°
C14C23C24H12180.0°179.7°
C14C23C24H13179.8°179.8°
C23C14C27H14179.4°179.7°
C25C24C23H13180.0°180.0°
C25C24C23H12179.8°180.0°
C24C25C26H25179.5°179.8°
C23C24C25H24180.0°180.0°
H1C18C19H41.1°38.3°
H1C18C19H5122.6°160.9°
H2C18C19H4120.5°84.9°
H2C18C19H51.0°37.8°
H3C15C19H437.0°23.0°
H3C15C19H5158.5°145.6°
H3C15N10H18109.5°151.7°
H6C20H7H8120.0°119.9°
H9C22H10H11120.0°120.0°
H12C23C24H130.2°0.0°
H13C24C25H240.0°0.0°
H14C27C26H250.8°0.7°
H24C25C26H250.5°0.2°
H26C28H27H28120.0°120.0°

226262

PDB entries from 2024-10-16

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