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7QU

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N4C14doub1.32Å1.36ÅAromatic
N4C13sing1.33Å1.38ÅAromatic
C14N5sing1.31Å1.34ÅAromatic
N3C13sing1.38Å1.36Å
C13C12doub1.40Å1.44ÅAromatic
N5C15doub1.33Å1.38ÅAromatic
C12C15sing1.41Å1.42ÅAromatic
C12C11sing1.47Å1.44ÅAromatic
C7C8sing1.54Å1.56Å
C7C6sing1.54Å1.58Å
C15N2sing1.37Å1.38ÅAromatic
CC1sing1.51Å1.51Å
C21C20doub1.39Å1.41ÅAromatic
C21C16sing1.39Å1.39ÅAromatic
N6C20sing1.40Å1.37Å
C11C16sing1.48Å1.45Å
C11C10doub1.36Å1.39ÅAromatic
N2C8sing1.46Å1.47Å
N2C10sing1.37Å1.41ÅAromatic
C20C19sing1.39Å1.41ÅAromatic
C16C17doub1.39Å1.39ÅAromatic
C4C5sing1.53Å1.52Å
C4N1sing1.48Å1.47Å
C8C9sing1.54Å1.57Å
C5Nsing1.47Å1.48Å
C17C18sing1.38Å1.38ÅAromatic
C19C18doub1.38Å1.38ÅAromatic
C19CLsing1.74Å1.72Å
C1Odoub1.21Å1.23Å
C1Nsing1.35Å1.40Å
C6N1sing1.47Å1.48Å
C6C9sing1.54Å1.57Å
NC2sing1.47Å1.47Å
N1C3sing1.47Å1.47Å
C3C2sing1.53Å1.51Å
C2H1sing1.09Å1.10Å
C2H2sing1.09Å1.10Å
C3H3sing1.09Å1.10Å
C3H4sing1.09Å1.10Å
C14H5sing1.08Å1.08Å
C17H6sing1.08Å1.08Å
C18H7sing1.08Å1.08Å
C21H8sing1.08Å1.08Å
CH9sing1.09Å1.10Å
CH10sing1.09Å1.10Å
CH11sing1.09Å1.10Å
C10H12sing1.08Å1.08Å
C4H13sing1.09Å1.10Å
C4H14sing1.09Å1.10Å
C5H15sing1.09Å1.10Å
C5H16sing1.09Å1.10Å
C6H17sing1.09Å1.10Å
C7H18sing1.09Å1.10Å
C7H19sing1.09Å1.10Å
C8H20sing1.09Å1.10Å
C9H21sing1.09Å1.10Å
C9H22sing1.09Å1.10Å
N3H24sing0.97Å1.00Å
N3H25sing0.97Å1.00Å
N6H26sing0.97Å1.00Å
N6H27sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C14N4C13116.5°121.0°
N4C14N5129.6°122.7°
N4C14H5115.2°118.6°
N4C13N3116.1°120.8°
N4C13C12120.8°118.3°
C14N5C15112.3°120.7°
N5C14H5115.2°118.7°
N3C13C12123.2°120.8°
C13N3H24109.5°120.0°
C13N3H25109.5°120.0°
C13C12C15114.9°118.7°
C13C12C11139.1°135.1°
N5C15C12125.9°118.5°
N5C15N2124.9°134.1°
C15C12C11105.9°106.2°
C12C15N2109.2°107.4°
C12C11C16128.1°126.7°
C12C11C10107.8°106.5°
C8C7C689.1°87.1°
C7C8N2121.6°113.6°
C7C8C990.8°87.1°
C8C7H18114.3°113.6°
C8C7H19114.3°113.6°
C7C8H20107.8°113.7°
C7C6N1116.5°113.6°
C7C6C990.4°87.1°
C7C6H17108.7°113.8°
C6C7H18114.3°113.6°
C6C7H19114.3°113.6°
C15N2C8120.4°124.9°
C15N2C10108.3°110.3°
CC1O120.4°120.1°
CC1N119.7°120.0°
C1CH9109.5°109.5°
C1CH10109.4°109.5°
C1CH11109.5°109.4°
C20C21C16119.4°119.8°
C21C20N6120.9°120.0°
C21C20C19117.7°120.0°
C20C21H8120.3°120.1°
C21C16C11120.3°120.0°
C21C16C17121.4°119.9°
C16C21H8120.3°120.1°
N6C20C19121.5°120.0°
C20N6H26109.5°120.0°
C20N6H27109.5°120.0°
C16C11C10124.0°126.8°
C11C16C17118.2°120.1°
C11C10N2108.8°109.6°
C11C10H12125.6°125.1°
C8N2C10131.3°124.9°
N2C8C9118.0°113.6°
N2C8H20109.1°112.9°
N2C10H12125.6°125.2°
C20C19C18122.3°120.2°
C20C19CL120.2°119.9°
C16C17C18120.0°120.0°
C16C17H6120.0°120.0°
C5C4N1111.8°109.4°
C4C5N113.5°108.5°
C5C4H13108.9°109.5°
C5C4H14108.9°109.5°
C4C5H15108.4°109.7°
C4C5H16108.5°109.6°
C4N1C6112.7°111.0°
C4N1C3109.1°111.2°
N1C4H13108.9°109.5°
N1C4H14108.9°109.3°
C8C9C689.4°87.1°
C9C8H20107.8°113.6°
C8C9H21114.2°113.6°
C8C9H22114.3°113.6°
C5NC1121.9°120.9°
C5NC2114.7°118.2°
NC5H15108.5°109.5°
NC5H16108.5°109.7°
C17C18C19119.2°120.2°
C18C17H6120.0°120.0°
C17C18H7120.4°119.9°
C18C19CL117.5°119.9°
C19C18H7120.4°119.9°
OC1N119.9°119.9°
C1NC2123.3°120.9°
N1C6C9120.9°113.6°
C6N1C3109.9°111.2°
N1C6H17109.9°112.8°
C9C6H17108.8°113.6°
C6C9H21114.2°113.6°
C6C9H22114.2°113.6°
NC2C3112.4°108.7°
NC2H1108.8°109.7°
NC2H2108.7°109.6°
N1C3C2112.1°109.3°
N1C3H3108.8°109.5°
N1C3H4108.9°109.5°
C3C2H1108.7°109.6°
C3C2H2108.7°109.6°
C2C3H3108.8°109.5°
C2C3H4108.8°109.5°
H1C2H2109.5°109.7°
H3C3H4109.5°109.5°
H9CH10109.5°109.5°
H9CH11109.5°109.4°
H10CH11109.5°109.4°
H13C4H14109.5°109.5°
H15C5H16109.5°109.7°
H18C7H19109.5°112.9°
H21C9H22109.5°112.9°
H24N3H25109.4°120.0°
H26N6H27109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N4C14N5H5180.0°180.0°
C14N4C13N3178.5°179.9°
C14N4C13C120.4°0.0°
N4C14N5C150.5°0.0°
C13N4C14N50.5°0.0°
N4C13N3C12178.9°179.9°
N4C13C12C151.1°0.1°
N4C13C12C11179.8°179.9°
C13N4C14H5179.5°180.0°
N4C13N3H240.0°179.9°
N4C13N3H25120.0°0.1°
C14N5C15C120.4°0.1°
C14N5C15N2179.4°180.0°
N3C13C12C15177.8°180.0°
N3C13C12C111.4°0.2°
C13N3H24H25120.0°180.0°
C13C12C15N51.1°0.1°
C13C12C15C11179.4°179.9°
C13C12C15N2178.7°179.9°
C13C12C11C163.8°0.1°
C13C12C11C10178.3°179.7°
C12C13N3H24178.9°0.0°
C12C13N3H2561.1°180.0°
N5C15C12N2179.8°180.0°
N5C15C12C11179.5°180.0°
N5C15N2C80.9°0.0°
N5C15N2C10179.8°179.8°
C15N5C14H5179.5°179.9°
C15C12C11C16177.1°180.0°
C15C12C11C100.8°0.2°
C12C15N2C8179.0°180.0°
C12C15N2C100.3°0.3°
C11C12C15N20.7°0.0°
C12C11C16C21141.3°129.5°
C12C11C16C10177.6°179.8°
C12C11C10N20.7°0.4°
C12C11C16C1739.2°50.2°
C12C11C10H12179.3°179.8°
C8C7C6H18116.4°114.6°
C8C7C6H19116.4°114.5°
C7C8N2C15119.5°120.0°
C7C8N2C9110.2°97.5°
C7C8N2H20126.4°131.3°
C7C8N2C1059.6°60.3°
C7C8C9H20109.0°114.6°
C8C7C6N1129.5°140.0°
C8C7C6C94.2°25.5°
C8C7C6H17105.8°89.1°
C8C7H18H19129.6°131.3°
C7C8C9H21112.2°140.0°
C7C8C9H22120.7°89.1°
C6C7C8N2128.3°140.0°
C7C6N1C41.6°82.5°
C7C6N1C9107.9°97.5°
C7C6N1H17124.1°131.4°
C7C6C9H17109.9°114.7°
C7C6N1C3123.5°153.1°
C6C7H18H19129.7°131.2°
C6C7C8H20104.8°89.1°
C7C6C9H21112.2°140.0°
C7C6C9H22120.7°89.1°
C15N2C10C110.2°0.4°
C15N2C8C10179.1°179.7°
C15N2C8C9130.3°142.5°
C15N2C10H12179.8°179.7°
C15N2C8H206.9°11.3°
CC1NC51.8°0.2°
CC1ON179.3°179.8°
CC1NC2179.8°179.7°
C1CH9H10120.0°120.1°
C1CH9H11120.0°120.0°
C1CH10H11120.0°119.9°
C20C21C16H8180.0°179.4°
C21C20N6C19180.0°179.7°
C20C21C16C11178.9°179.6°
C20C21C16C170.6°0.6°
C21C20C19C180.3°0.4°
C21C20C19CL179.8°179.7°
C21C20N6H26180.0°179.7°
C21C20N6H2760.0°0.3°
C16C21C20N6179.8°179.7°
C21C16C11C17179.5°179.7°
C21C16C11C1041.1°50.3°
C16C21C20C190.1°0.7°
C21C16C17C180.6°0.4°
C21C16C17H6179.4°179.8°
N6C20C19C18179.7°179.9°
N6C20C19CL0.1°0.0°
N6C20C21H80.2°0.3°
C20N6H26H27120.0°180.0°
C16C11C10N2177.3°179.8°
C11C16C17C18178.9°179.9°
C11C16C17H61.1°0.1°
C11C16C21H81.2°0.3°
C16C11C10H122.7°0.0°
C11C10N2C8179.4°179.9°
C11C10N2H12180.0°179.9°
C10C11C16C17138.4°130.0°
N2C8C9H20124.0°130.9°
N2C8C9C6131.2°140.0°
C8N2C10H120.6°0.0°
N2C8C7H18115.3°25.4°
N2C8C7H1911.9°105.5°
N2C8C9H2114.7°105.5°
N2C8C9H22112.4°25.5°
C10N2C8C950.6°37.2°
C10N2C8H20174.0°168.4°
C20C19C18C170.4°0.1°
C20C19C18CL179.8°179.9°
C20C19C18H7179.6°180.0°
C19C20C21H8179.8°180.0°
C19C20N6H260.0°0.0°
C19C20N6H27120.0°180.0°
C16C17C18H6180.0°179.8°
C16C17C18C190.1°0.1°
C16C17C18H7179.9°179.9°
C17C16C21H8179.4°180.0°
C5C4N1H13120.4°120.0°
C5C4N1H14120.4°120.0°
C4C5NH15120.6°119.7°
C4C5NH16120.6°119.8°
C4C5NC1135.3°128.8°
C5C4N1C6179.1°172.7°
C4C5NC243.2°51.2°
C5C4N1C358.5°62.9°
C5C4H13H14119.0°120.1°
C4C5H15H16118.2°120.5°
N1C4C5N50.3°53.7°
C4N1C6C3121.9°124.3°
C4N1C6C9109.5°180.0°
C4N1C3C260.4°62.9°
C4N1C3H3179.2°57.1°
C4N1C3H460.0°177.2°
N1C4H13H14118.9°119.9°
N1C4C5H15170.9°65.9°
N1C4C5H1670.3°173.6°
C4N1C6H17122.5°48.9°
C8C9C6N1125.8°140.0°
C8C9C6H21116.4°114.5°
C8C9C6H22116.5°114.6°
C8C9C6H17105.7°89.2°
C9C8C7H18120.6°89.1°
C9C8C7H19112.2°140.0°
C8C9H21H22129.6°131.3°
C5NC1O177.5°180.0°
C5NC1C2178.4°179.9°
C5NC2C344.3°51.3°
C5NC2H1164.7°68.5°
C5NC2H276.1°171.1°
NC5C4H13170.7°173.8°
NC5C4H1470.0°66.1°
NC5H15H16118.2°120.5°
C17C18C19H7180.0°179.8°
C17C18C19CL179.8°180.0°
C19C18C17H6179.9°180.0°
CLC19C18H70.2°0.2°
OC1NC20.9°0.1°
OC1CH90.0°89.9°
OC1CH10120.0°150.0°
OC1CH11120.0°30.0°
C1NC2C3134.2°128.7°
C1NC2H113.7°111.4°
C1NC2H2105.4°9.0°
NC1CH9179.3°90.3°
NC1CH1059.3°29.8°
NC1CH1160.7°149.7°
C1NC5H1514.8°111.5°
C1NC5H16104.1°9.1°
N1C6C9H17128.5°130.8°
C6N1C3C2175.5°172.9°
C6N1C3H355.2°67.2°
C6N1C3H464.1°53.0°
C6N1C4H1358.7°52.7°
C6N1C4H1460.5°67.3°
N1C6C7H18114.2°25.4°
N1C6C7H1913.1°105.5°
N1C6C9H219.4°105.4°
N1C6C9H22117.7°25.4°
C9C6N1C3128.6°55.7°
C9C6C7H18120.6°89.1°
C9C6C7H19112.1°140.0°
C6C9C8H20104.8°89.1°
C6C9H21H22129.5°131.2°
NC2C3N153.5°54.0°
NC2C3H1120.5°119.8°
NC2C3H2120.4°119.7°
NC2H1H2118.6°120.3°
NC2C3H3173.8°66.0°
NC2C3H466.9°173.9°
C2NC5H15163.7°68.5°
C2NC5H1677.4°171.0°
N1C3C2H3120.4°120.0°
N1C3C2H4120.4°119.9°
N1C3C2H1173.9°65.9°
N1C3C2H266.9°173.7°
N1C3H3H4118.9°120.1°
C3N1C4H13178.9°177.1°
C3N1C4H1461.9°57.1°
C3N1C6H170.6°75.5°
C3C2H1H2118.7°120.4°
C2C3H3H4118.8°120.1°
H1C2C3H365.7°174.2°
H1C2C3H453.5°54.1°
H2C2C3H353.4°53.7°
H2C2C3H4172.7°66.4°
H6C17C18H70.1°0.2°
H9CH10H11120.0°120.0°
H13C4C5H1568.7°54.1°
H13C4C5H1650.1°66.4°
H14C4C5H1550.6°174.2°
H14C4C5H16169.4°53.7°
H17C6C7H1810.6°156.3°
H17C6C7H19137.8°25.4°
H17C6C9H21137.9°25.3°
H17C6C9H2210.8°156.2°
H18C7C8H2011.6°156.4°
H19C7C8H20138.8°25.4°
H20C8C9H21138.8°25.4°
H20C8C9H2211.7°156.4°

250835

PDB entries from 2026-03-18

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