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7KH

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N7C8doub1.29Å1.32Å
C8C20sing1.48Å1.45Å
C20N21doub1.33Å1.36ÅAromatic
C20N19sing1.33Å1.31ÅAromatic
N21C22sing1.33Å1.32ÅAromatic
C5C4sing1.53Å1.57Å
C5N6sing1.47Å1.46Å
C4O3sing1.43Å1.42Å
N19C18doub1.33Å1.32ÅAromatic
C22N6sing1.38Å1.38Å
C22N17doub1.33Å1.33ÅAromatic
N6C1sing1.47Å1.48Å
O3C2sing1.43Å1.40Å
C18N17sing1.33Å1.36ÅAromatic
C18N16sing1.38Å1.33Å
C1C2sing1.53Å1.56Å
C14C13sing1.54Å1.48Å
C14C15sing1.54Å1.55Å
C13C12sing1.54Å1.58Å
C15N16sing1.47Å1.54Å
C15C11sing1.55Å1.50Å
N16C10sing1.46Å1.50Å
C12C11sing1.55Å1.59Å
C10C9sing1.51Å1.53Å
C26C9doub1.35Å1.37ÅAromatic
C26N25sing1.37Å1.43ÅAromatic
C9N23sing1.33Å1.37ÅAromatic
N25C27sing1.36Å1.40ÅAromatic
N25C24sing1.37Å1.37ÅAromatic
C27C28doub1.35Å1.37ÅAromatic
N23C24doub1.33Å1.33ÅAromatic
C24C30sing1.41Å1.37ÅAromatic
C28C29sing1.40Å1.49ÅAromatic
C30C29doub1.36Å1.36ÅAromatic
C5H1sing1.09Å1.10Å
C5H2sing1.09Å1.10Å
C8H3sing1.08Å1.08Å
C1H4sing1.09Å1.10Å
C1H5sing1.09Å1.10Å
C14H6sing1.09Å1.10Å
C14H7sing1.09Å1.10Å
C4H8sing1.09Å1.10Å
C4H9sing1.09Å1.10Å
C13H10sing1.09Å1.10Å
C13H11sing1.09Å1.10Å
C2H12sing1.09Å1.10Å
C2H13sing1.09Å1.10Å
N7H14sing0.97Å1.00Å
C10H15sing1.09Å1.10Å
C10H16sing1.09Å1.10Å
C11H17sing1.09Å1.10Å
C11H18sing1.09Å1.10Å
C12H19sing1.09Å1.10Å
C12H20sing1.09Å1.10Å
C15H21sing1.09Å1.10Å
C26H22sing1.08Å1.08Å
C27H23sing1.08Å1.08Å
C28H24sing1.08Å1.08Å
C29H25sing1.08Å1.08Å
C30H26sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N7C8C20123.9°120.0°
N7C8H3118.1°120.0°
C8N7H14112.0°119.9°
C8C20N21116.6°120.0°
C8C20N19117.8°120.0°
C20C8H3118.0°120.0°
N21C20N19125.6°120.0°
C20N21C22112.7°120.0°
C20N19C18117.0°120.0°
N21C22N6116.9°120.0°
N21C22N17126.9°120.1°
C4C5N6107.5°109.3°
C5C4O3119.1°109.3°
C4C5H1109.9°109.6°
C4C5H2110.0°109.5°
C5C4H8107.0°109.5°
C5C4H9107.0°109.5°
C5N6C22118.5°111.0°
C5N6C1116.9°110.8°
N6C5H1110.0°109.5°
N6C5H2110.0°109.4°
C4O3C2118.0°113.8°
O3C4H8107.0°109.5°
O3C4H9107.0°109.5°
N19C18N17123.0°120.1°
N19C18N16120.4°120.0°
N6C22N17115.9°119.9°
C22N6C1122.5°111.0°
C22N17C18114.6°119.9°
N6C1C2104.9°109.3°
N6C1H4110.6°109.5°
N6C1H5110.6°109.5°
O3C2C1115.0°109.2°
O3C2H12108.0°109.5°
O3C2H13108.1°109.5°
N17C18N16116.5°120.0°
C18N16C15115.8°120.0°
C18N16C10122.6°120.0°
C2C1H4110.6°109.5°
C2C1H5110.6°109.5°
C1C2H12108.1°109.5°
C1C2H13108.0°109.5°
C13C14C15105.1°106.6°
C14C13C12105.3°106.6°
C13C14H6110.5°110.0°
C13C14H7110.5°110.0°
C14C13H10110.5°110.0°
C14C13H11110.5°110.1°
C14C15N16112.0°110.5°
C14C15C11104.4°104.2°
C15C14H6110.5°110.0°
C15C14H7110.5°110.1°
C14C15H21108.0°110.5°
C13C12C11105.4°104.2°
C12C13H10110.5°110.0°
C12C13H11110.5°110.1°
C13C12H19110.5°110.5°
C13C12H20110.5°110.5°
N16C15C11115.5°110.5°
C15N16C10121.4°120.0°
N16C15H21108.1°110.4°
C15C11C1299.5°102.8°
C15C11H17111.9°110.7°
C15C11H18111.9°110.9°
C11C15H21108.6°110.6°
N16C10C9113.2°109.5°
N16C10H15108.6°109.4°
N16C10H16108.6°109.5°
C12C11H17111.9°110.8°
C12C11H18111.9°110.8°
C11C12H19110.5°110.5°
C11C12H20110.5°110.5°
C10C9C26127.5°125.7°
C10C9N23122.7°125.7°
C9C10H15108.5°109.5°
C9C10H16108.5°109.5°
C9C26N25107.7°107.2°
C26C9N23109.8°108.6°
C9C26H22126.2°126.4°
C26N25C27131.1°132.6°
C26N25C24102.4°107.0°
N25C26H22126.2°126.4°
C9N23C24105.5°109.2°
C27N25C24126.4°120.5°
N25C27C28116.9°120.6°
N25C27H23121.5°119.7°
N25C24N23114.6°108.1°
N25C24C30118.7°119.6°
C27C28C29115.7°120.3°
C28C27H23121.6°119.7°
C27C28H24122.2°119.9°
N23C24C30126.6°132.3°
C24C30C29117.4°119.3°
C24C30H26121.3°120.3°
C28C29C30124.8°119.7°
C29C28H24122.1°119.8°
C28C29H25117.6°120.2°
C30C29H25117.6°120.1°
C29C30H26121.3°120.3°
H1C5H2109.4°109.5°
H4C1H5109.5°109.5°
H6C14H7109.5°110.0°
H8C4H9109.5°109.6°
H10C13H11109.4°110.1°
H12C2H13109.5°109.6°
H15C10H16109.4°109.5°
H17C11H18109.5°110.6°
H19C12H20109.5°110.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N7C8C20H3180.0°180.0°
N7C8C20N214.4°0.0°
N7C8C20N19175.7°179.9°
C8C20N21N19179.9°179.9°
C8C20N21C22176.1°179.7°
C8C20N19C18178.4°180.0°
C20C8N7H14180.0°180.0°
N21C20N19C181.5°0.1°
C20N21C22N6176.9°180.0°
C20N21C22N173.0°0.6°
N21C20C8H3175.6°180.0°
N19C20N21C223.7°0.3°
C20N19C18N171.9°0.0°
C20N19C18N16178.7°179.7°
N19C20C8H34.3°0.1°
N21C22N6C51.7°0.0°
N21C22N6N17174.6°179.4°
N21C22N6C1164.5°123.6°
N21C22N17C180.2°0.6°
C4C5N6H1119.7°120.0°
C4C5N6H2119.7°119.9°
C5C4O3H8121.4°119.9°
C5C4O3H9121.4°119.9°
C4C5N6C22143.8°177.6°
C4C5N6C152.4°58.6°
C5C4O3C231.3°58.7°
C4C5H1H2120.9°120.2°
C5C4H8H9115.6°120.1°
N6C5C4O334.0°56.8°
C5N6C22C1162.8°123.7°
C5N6C22N17172.9°179.5°
C5N6C1C262.2°58.6°
N6C5H1H2120.9°120.0°
C5N6C1H4178.5°61.3°
C5N6C1H557.1°178.5°
N6C5C4H8155.4°176.8°
N6C5C4H987.3°63.1°
C4O3C2C141.6°58.7°
O3C4C5H1153.8°176.8°
O3C4C5H285.7°63.1°
O3C4H8H9115.6°120.1°
C4O3C2H12162.4°61.2°
C4O3C2H1379.2°178.6°
N19C18N17C222.5°0.3°
N19C18N17N16176.9°179.7°
N19C18N16C151.9°0.3°
N19C18N16C10172.5°179.7°
N6C22N17C18174.1°180.0°
C22N6C1C2134.7°177.6°
C22N6C5H124.1°57.6°
C22N6C5H296.5°62.5°
C22N6C1H415.4°62.5°
C22N6C1H5106.0°57.7°
N17C22N6C110.1°55.8°
C22N17C18N16179.4°180.0°
N6C1C2O353.7°56.8°
N6C1C2H4119.3°119.9°
N6C1C2H5119.3°120.0°
C1N6C5H1172.1°178.6°
C1N6C5H267.3°61.3°
N6C1H4H5122.1°120.2°
N6C1C2H12174.5°63.0°
N6C1C2H1367.1°176.8°
O3C2C1H12120.8°119.9°
O3C2C1H13120.8°120.0°
O3C2C1H4173.0°63.1°
O3C2C1H565.6°176.8°
C2O3C4H8152.7°178.6°
C2O3C4H990.0°61.2°
O3C2H12H13117.5°120.1°
N17C18N16C15178.9°180.0°
N17C18N16C104.5°0.0°
C18N16C15C1475.5°60.0°
C18N16C15C10174.5°180.0°
C18N16C15C11165.2°54.8°
C18N16C10C983.5°90.0°
C18N16C10H15155.9°30.0°
C18N16C10H1637.0°150.0°
C18N16C15H2143.3°177.5°
C2C1H4H5122.1°120.1°
C1C2H12H13117.5°120.2°
C13C14C15H6119.3°119.3°
C13C14C15H7119.3°119.3°
C14C13C12H10119.4°119.3°
C14C13C12H11119.3°119.3°
C13C14C15N16167.0°142.3°
C13C14C15C1141.4°23.6°
C14C13C12C118.3°23.6°
C13C14H6H7122.0°121.4°
C14C13H10H11121.9°121.4°
C14C13C12H19127.7°142.3°
C14C13C12H20111.0°95.1°
C13C14C15H2174.1°95.2°
C15C14C13C1218.7°0.0°
C14C15N16C11119.3°114.8°
C14C15N16H21118.8°122.6°
C14C15C11H21115.0°118.8°
C14C15N16C1099.0°120.0°
C14C15C11C1244.3°38.0°
C15C14H6H7122.0°121.4°
C15C14C13H10138.1°119.3°
C15C14C13H11100.6°119.3°
C14C15C11H17162.6°80.4°
C14C15C11H1874.0°156.4°
C13C12C11C1532.5°37.9°
C13C12C11H19119.4°118.7°
C13C12C11H20119.3°118.7°
C12C13C14H6138.0°119.3°
C12C13C14H7100.6°119.3°
C12C13H10H11121.9°121.4°
C13C12C11H17150.8°80.4°
C13C12C11H1885.9°156.5°
C13C12H19H20121.9°122.6°
N16C15C11H21121.6°122.6°
N16C15C11C12167.7°156.6°
C15N16C10C990.6°90.0°
N16C15C14H673.7°98.4°
N16C15C14H747.7°23.0°
C15N16C10H1530.0°150.0°
C15N16C10H16148.9°30.0°
N16C15C11H1774.0°38.3°
N16C15C11H1849.3°85.0°
C11C15N16C1020.3°125.2°
C15C11C12H17118.3°118.3°
C15C11C12H18118.4°118.5°
C11C15C14H6160.7°142.9°
C11C15C14H777.9°95.7°
C15C11H17H18124.7°123.4°
C15C11C12H19151.9°156.6°
C15C11C12H2086.9°80.7°
N16C10C9H15120.6°120.0°
N16C10C9H16120.6°120.0°
N16C10C9C2685.7°94.8°
N16C10C9N2393.6°85.0°
N16C10H15H16118.3°120.0°
C10N16C15H21142.2°2.5°
C11C12C13H10111.0°95.7°
C11C12C13H11127.7°142.9°
C12C11H17H18124.6°123.2°
C11C12H19H20121.8°122.6°
C12C11C15H2170.7°80.8°
C10C9C26N23179.4°179.8°
C10C9C26N25179.9°179.9°
C10C9N23C24179.0°180.0°
C9C10H15H16118.3°120.0°
C10C9C26H220.1°0.2°
C9C26N25H22180.0°179.6°
C9C26N25C27179.2°179.9°
C9C26N25C240.7°0.4°
C26C9N23C241.5°0.2°
C26C9C10H15153.7°145.3°
C26C9C10H1634.8°25.3°
N25C26C9N230.5°0.3°
C26N25C27C24178.3°179.7°
C26N25C27C28179.0°179.7°
C26N25C24N231.7°0.3°
C26N25C24C30179.5°179.7°
C26N25C27H230.9°0.3°
C9N23C24N252.1°0.1°
C9N23C24C30179.7°180.0°
N23C9C10H1527.0°34.9°
N23C9C10H16145.8°155.0°
N23C9C26H22179.5°180.0°
N25C27C28H23180.0°180.0°
C27N25C24N23179.6°180.0°
C27N25C24C301.8°0.0°
N25C27C28C291.3°0.1°
C27N25C26H220.7°0.3°
N25C27C28H24178.7°180.0°
C24N25C27C282.7°0.0°
N25C24N23C30177.6°180.0°
N25C24C30C290.5°0.1°
C24N25C26H22179.3°180.0°
C24N25C27H23177.3°180.0°
N25C24C30H26179.5°180.0°
C27C28C29H24180.0°179.9°
C27C28C29C300.9°0.1°
C27C28C29H25179.1°180.0°
N23C24C30C29177.0°180.0°
N23C24C30H263.0°0.0°
C24C30C29C281.8°0.1°
C24C30C29H26180.0°180.0°
C24C30C29H25178.2°180.0°
C28C29C30H25180.0°179.9°
C29C28C27H23178.7°179.9°
C28C29C30H26178.2°179.9°
C30C29C28H24179.1°180.0°
H1C5C4H884.9°63.3°
H1C5C4H932.4°56.8°
H2C5C4H835.7°56.9°
H2C5C4H9153.0°177.0°
H3C8N7H140.0°0.0°
H4C1C2H1266.2°177.0°
H4C1C2H1352.2°56.9°
H5C1C2H1255.2°56.9°
H5C1C2H13173.6°63.2°
H6C14C13H10102.6°121.4°
H6C14C13H1118.7°0.0°
H6C14C15H2145.2°24.1°
H7C14C13H1018.8°0.0°
H7C14C13H11140.1°121.4°
H7C14C15H21166.6°145.5°
H10C13C12H198.4°23.0°
H10C13C12H20129.6°145.6°
H11C13C12H19112.9°98.4°
H11C13C12H208.3°24.2°
H17C11C12H1989.8°38.3°
H17C11C12H2031.5°161.0°
H17C11C15H2147.7°160.9°
H18C11C12H1933.5°84.8°
H18C11C12H20154.8°37.8°
H18C11C15H21171.0°37.6°
H23C27C28H241.3°0.0°
H24C28C29H250.9°0.1°
H25C29C30H261.8°0.0°

222415

PDB entries from 2024-07-10

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