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A1AF6

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.41Å1.39Å
C1C5doub1.36Å1.38Å
O1C2doub1.22Å1.25Å
C2N1sing1.34Å1.34Å
N1C3sing1.38Å1.32Å
C3C4sing1.41Å1.50ÅAromatic
C3C9doub1.40Å1.47ÅAromatic
C5C4sing1.46Å1.39Å
C4C6doub1.40Å1.39ÅAromatic
C6C7sing1.37Å1.38ÅAromatic
C7C8doub1.39Å1.41ÅAromatic
C8C9sing1.38Å1.42ÅAromatic
C9N2sing1.40Å1.35Å
N2N3sing1.40Å1.38Å
N2C11sing1.35Å1.31Å
N3C10doub1.29Å1.36Å
C10N4sing1.37Å1.34Å
C12C10sing1.51Å1.50Å
N4C11sing1.35Å1.34Å
C11O2doub1.22Å1.34Å
C12C13sing1.53Å1.55Å
C16C12sing1.53Å1.51Å
C13C14sing1.53Å1.52Å
C14C15sing1.53Å1.49Å
C15N5sing1.47Å1.45Å
N5C16sing1.47Å1.45Å
C17N5sing1.47Å1.47Å
C18C17sing1.53Å1.54Å
C19C18sing1.53Å1.53Å
C19C20sing1.53Å1.50Å
C24C19sing1.53Å1.50Å
C20C21sing1.53Å1.52Å
C21C22sing1.53Å1.52Å
C22C23sing1.53Å1.51Å
C23C24sing1.53Å1.50Å
N1HN1sing0.97Å1.00Å
C8H8sing1.08Å1.08Å
C7H7sing1.08Å1.08Å
C6H6sing1.08Å1.08Å
C5H5sing1.08Å1.08Å
C1H1sing1.08Å1.08Å
N4HN4sing0.97Å1.00Å
C12H12sing1.09Å1.10Å
C16H162sing1.09Å1.10Å
C16H161sing1.09Å1.10Å
C15H152sing1.09Å1.10Å
C15H151sing1.09Å1.10Å
C14H142sing1.09Å1.10Å
C14H141sing1.09Å1.10Å
C13H132sing1.09Å1.10Å
C13H131sing1.09Å1.10Å
C17H171sing1.09Å1.10Å
C17H172sing1.09Å1.10Å
C18H181sing1.09Å1.10Å
C18H182sing1.09Å1.10Å
C19H19sing1.09Å1.10Å
C24H242sing1.09Å1.10Å
C24H241sing1.09Å1.10Å
C23H232sing1.09Å1.10Å
C23H231sing1.09Å1.10Å
C22H222sing1.09Å1.10Å
C22H221sing1.09Å1.10Å
C21H212sing1.09Å1.10Å
C21H211sing1.09Å1.10Å
C20H202sing1.09Å1.10Å
C20H201sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C5119.9°120.3°
C1C2O1120.4°119.2°
C1C2N1122.4°121.6°
C2C1H1120.0°119.9°
C1C5C4119.5°118.6°
C1C5H5120.2°120.7°
C5C1H1120.1°119.9°
O1C2N1117.1°119.2°
C2N1C3120.7°120.9°
C2N1HN1119.7°119.5°
N1C3C4120.1°119.7°
N1C3C9120.0°120.9°
C3N1HN1119.7°119.6°
C4C3C9119.9°119.4°
C3C4C5117.4°119.0°
C3C4C6121.3°119.9°
C3C9C8113.8°119.6°
C3C9N2114.7°120.2°
C5C4C6121.3°121.2°
C4C5H5120.2°120.7°
C4C6C7118.1°119.9°
C4C6H6120.9°120.0°
C6C7C8122.6°120.7°
C6C7H7118.7°119.7°
C7C6H6121.0°120.1°
C7C8C9124.3°120.6°
C7C8H8117.9°119.7°
C8C7H7118.7°119.6°
C8C9N2131.4°120.2°
C9C8H8117.8°119.7°
C9N2N3116.6°126.4°
C9N2C11128.2°126.3°
N3N2C11105.8°107.3°
N2N3C10107.3°108.1°
N2C11N4112.3°107.4°
N2C11O2125.1°126.3°
N3C10N4108.6°108.8°
N3C10C12126.9°125.6°
N4C10C12124.4°125.6°
C10N4C11106.0°108.4°
C10N4HN4127.0°125.8°
C10C12C13111.0°109.5°
C10C12C16108.7°109.5°
C10C12H12111.0°109.5°
N4C11O2122.5°126.3°
C11N4HN4127.0°125.9°
C13C12C16104.9°109.3°
C12C13C14112.7°109.2°
C13C12H12110.3°109.5°
C12C13H132108.7°109.6°
C12C13H131108.7°109.6°
C12C16N5108.5°109.5°
C16C12H12110.8°109.5°
C12C16H162109.7°109.5°
C12C16H161109.7°109.5°
C13C14C15108.4°109.2°
C13C14H142109.8°109.5°
C13C14H141109.7°109.5°
C14C13H132108.6°109.5°
C14C13H131108.7°109.5°
C14C15N5113.2°109.5°
C14C15H152108.5°109.5°
C14C15H151108.5°109.5°
C15C14H142109.7°109.5°
C15C14H141109.8°109.5°
C15N5C16114.5°111.2°
C15N5C17108.8°111.0°
N5C15H152108.5°109.4°
N5C15H151108.6°109.5°
C16N5C17105.2°111.0°
N5C16H162109.7°109.5°
N5C16H161109.7°109.4°
N5C17C18110.5°109.5°
N5C17H171109.2°109.5°
N5C17H172109.2°109.5°
C17C18C19115.8°109.5°
C18C17H171109.2°109.4°
C18C17H172109.2°109.5°
C17C18H181107.9°109.5°
C17C18H182107.9°109.5°
C18C19C20109.1°109.5°
C18C19C24107.8°109.5°
C19C18H181107.9°109.5°
C19C18H182107.9°109.5°
C18C19H19110.1°109.5°
C20C19C24108.8°109.4°
C19C20C21113.0°109.5°
C20C19H19110.5°109.5°
C19C20H202108.6°109.4°
C19C20H201108.6°109.5°
C19C24C23112.8°109.5°
C24C19H19110.5°109.5°
C19C24H242108.6°109.5°
C19C24H241108.6°109.4°
C20C21C22105.9°109.4°
C20C21H212110.4°109.5°
C20C21H211110.4°109.5°
C21C20H202108.6°109.4°
C21C20H201108.6°109.5°
C21C22C23111.0°109.5°
C21C22H222109.1°109.5°
C21C22H221109.1°109.5°
C22C21H212110.3°109.5°
C22C21H211110.3°109.4°
C22C23C24111.3°109.4°
C22C23H232109.0°109.5°
C22C23H231109.0°109.5°
C23C22H222109.1°109.5°
C23C22H221109.1°109.4°
C23C24H242108.6°109.5°
C23C24H241108.6°109.5°
C24C23H232109.0°109.5°
C24C23H231109.0°109.5°
H162C16H161109.5°109.4°
H152C15H151109.4°109.5°
H142C14H141109.4°109.5°
H132C13H131109.5°109.6°
H171C17H172109.5°109.5°
H181C18H182109.5°109.4°
H242C24H241109.5°109.5°
H232C23H231109.5°109.5°
H222C22H221109.5°109.4°
H212C21H211109.5°109.5°
H202C20H201109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C5H1180.0°180.0°
C1C2O1N1177.7°179.9°
C1C2N1C30.9°0.1°
C2C1C5C40.4°0.0°
C1C2N1HN1179.1°180.0°
C2C1C5H5179.6°179.9°
C5C1C2O1178.7°179.9°
C5C1C2N11.1°0.0°
C1C5C4C32.0°0.0°
C1C5C4H5180.0°179.9°
C1C5C4C6180.0°180.0°
O1C2N1C3178.5°180.0°
O1C2N1HN11.5°0.1°
O1C2C1H11.3°0.0°
C2N1C3HN1180.0°179.9°
C2N1C3C40.8°0.0°
C2N1C3C9177.9°180.0°
N1C2C1H1178.9°180.0°
N1C3C4C9178.7°179.9°
N1C3C4C52.2°0.0°
N1C3C4C6179.8°180.0°
N1C3C9C8179.8°179.7°
N1C3C9N23.9°0.1°
C3C4C5C6178.0°180.0°
C3C4C6C70.2°0.3°
C4C3C9C81.1°0.4°
C4C3C9N2174.8°180.0°
C4C3N1HN1179.2°180.0°
C3C4C6H6179.8°180.0°
C3C4C5H5178.0°179.9°
C9C3C4C5176.4°179.9°
C9C3C4C61.6°0.0°
C3C9C8C70.5°0.4°
C3C9C8N2175.0°179.6°
C3C9N2N3155.4°55.0°
C3C9N2C1163.3°125.1°
C9C3N1HN12.1°0.1°
C3C9C8H8179.5°179.7°
C5C4C6C7177.7°179.8°
C5C4C6H62.3°0.1°
C4C5C1H1179.6°180.0°
C4C6C7H6180.0°179.7°
C4C6C7C81.5°0.2°
C4C6C7H7178.5°179.8°
C6C4C5H50.0°0.1°
C6C7C8H7180.0°180.0°
C6C7C8C91.9°0.1°
C6C7C8H8178.1°180.0°
C7C8C9H8180.0°179.9°
C7C8C9N2175.6°180.0°
C8C7C6H6178.5°180.0°
C8C9N2N319.6°124.7°
C8C9N2C11121.7°55.3°
C9C8C7H7178.1°179.9°
C9N2N3C11149.3°180.0°
C9N2N3C10150.0°179.9°
C9N2C11N4145.3°179.8°
C9N2C11O235.8°0.1°
N2C9C8H84.4°0.1°
N2N3C10N40.3°0.0°
N2N3C10C12177.0°179.8°
N3N2C11N40.8°0.3°
N3N2C11O2179.7°180.0°
C11N2N3C100.7°0.2°
N2C11N4C100.6°0.3°
N2C11N4O2178.9°179.7°
N2C11N4HN4179.4°179.8°
N3C10N4C12176.8°179.8°
N3C10N4C110.2°0.2°
N3C10C12C13131.5°95.2°
N3C10C12C1616.6°24.6°
N3C10N4HN4179.8°179.9°
N3C10C12H12105.5°144.7°
C10N4C11HN4180.0°179.9°
C10N4C11O2179.5°180.0°
N4C10C12C1344.6°85.1°
N4C10C12C16159.5°155.2°
N4C10C12H1278.4°35.0°
C12C10N4C11176.6°180.0°
C10C12C13C16117.2°119.9°
C10C12C13H12123.4°120.1°
C10C12C16H12122.3°120.1°
C10C12C13C14179.0°177.6°
C10C12C16N5179.3°179.1°
C12C10N4HN43.4°0.1°
C10C12C16H16260.8°59.1°
C10C12C16H16159.5°60.9°
C10C12C13H13260.6°62.5°
C10C12C13H13158.5°57.7°
O2C11N4HN40.5°0.1°
C13C12C16H12119.0°120.0°
C12C13C14H132120.5°119.9°
C12C13C14H131120.5°119.9°
C12C13C14C1554.9°57.7°
C13C12C16N561.9°59.2°
C13C12C16H16257.9°60.8°
C13C12C16H161178.2°179.2°
C12C13C14H14264.9°177.6°
C12C13C14H141174.8°62.3°
C12C13H132H131118.5°120.2°
C16C12C13C1461.8°57.7°
C12C16N5C1561.6°61.7°
C12C16N5H162119.8°120.0°
C12C16N5H161119.9°120.1°
C12C16N5C17178.9°174.2°
C12C16H162H161120.5°120.0°
C16C12C13H132177.8°177.5°
C16C12C13H13158.7°62.2°
C13C14C15H142119.9°119.9°
C13C14C15H141119.9°119.9°
C13C14C15N548.9°59.2°
C14C13C12H1257.6°62.3°
C13C14C15H152169.5°60.8°
C13C14C15H15171.6°179.2°
C13C14H142H141120.5°120.1°
C14C13H132H131118.5°120.1°
C14C15N5H152120.6°120.0°
C14C15N5H151120.6°120.0°
C14C15N5C1654.9°61.8°
C14C15N5C17172.3°174.2°
C14C15H152H151118.3°120.0°
C15C14H142H141120.5°120.1°
C15C14C13H132175.4°177.6°
C15C14C13H13165.6°62.3°
C15N5C16C17119.4°124.1°
C15N5C17C1864.6°65.8°
C15N5C16H16258.2°58.3°
C15N5C16H161178.5°178.2°
N5C15H152H151118.3°120.0°
N5C15C14H14270.9°179.1°
N5C15C14H141168.8°60.8°
C15N5C17H17155.5°54.1°
C15N5C17H172175.2°174.2°
C16N5C17C18172.2°170.0°
N5C16C12H1257.1°60.8°
N5C16H162H161120.5°119.9°
C16N5C15H152175.5°58.3°
C16N5C15H15165.7°178.2°
C16N5C17H17167.6°70.1°
C16N5C17H17252.1°50.0°
N5C17C18H171120.2°120.0°
N5C17C18H172120.1°120.0°
N5C17C18C19158.6°180.0°
C17N5C16H16261.2°65.8°
C17N5C16H16159.1°54.1°
C17N5C15H15267.2°65.8°
C17N5C15H15151.7°54.2°
N5C17H171H172119.5°120.1°
N5C17C18H18137.7°60.0°
N5C17C18H18280.5°60.0°
C17C18C19H181120.9°120.0°
C17C18C19H182120.9°120.0°
C17C18C19C2063.6°175.0°
C17C18C19C24178.4°65.1°
C18C17H171H172119.5°120.0°
C17C18H181H182117.1°120.0°
C17C18C19H1957.8°54.9°
C18C19C20C24117.4°119.9°
C18C19C20H19121.1°120.0°
C18C19C24H19120.3°120.0°
C18C19C20C21176.6°180.0°
C18C19C24C23171.6°180.0°
C19C18C17H17181.2°60.0°
C19C18C17H17238.5°60.0°
C19C18H181H182117.1°120.0°
C18C19C24H24251.1°59.9°
C18C19C24H24167.9°60.0°
C18C19C20H20262.9°60.1°
C18C19C20H20156.0°59.9°
C20C19C24H19121.5°120.0°
C19C20C21H202120.5°119.9°
C19C20C21H201120.6°120.0°
C19C20C21C2261.7°60.1°
C20C19C24C2353.4°60.1°
C20C19C18H18157.4°55.0°
C20C19C18H182175.5°65.0°
C20C19C24H24267.1°60.0°
C20C19C24H241173.9°180.0°
C19C20C21H21257.7°180.0°
C19C20C21H211178.9°59.9°
C19C20H202H201118.4°120.0°
C24C19C20C2159.2°60.1°
C19C24C23C2253.6°60.0°
C19C24C23H242120.5°120.1°
C19C24C23H241120.5°119.9°
C24C19C18H18160.7°174.9°
C24C19C18H18257.5°55.0°
C19C24H242H241118.5°120.0°
C19C24C23H23266.7°180.0°
C19C24C23H231173.8°60.0°
C24C19C20H202179.7°180.0°
C24C19C20H20161.4°60.0°
C20C21C22H212119.5°120.0°
C20C21C22H211119.4°120.0°
C20C21C22C2359.1°60.0°
C21C20C19H1962.3°59.9°
C20C21C22H222179.3°60.0°
C20C21C22H22161.1°180.0°
C20C21H212H211121.7°120.1°
C21C20H202H201118.4°120.1°
C21C22C23H222120.2°120.0°
C21C22C23H221120.2°120.0°
C21C22C23C2456.9°60.0°
C21C22C23H23263.4°180.0°
C21C22C23H231177.1°60.0°
C21C22H222H221119.3°120.0°
C22C21H212H211121.6°119.9°
C22C21C20H202177.8°179.9°
C22C21C20H20158.9°60.0°
C22C23C24H232120.3°120.0°
C22C23C24H231120.3°120.0°
C22C23C24H24266.9°60.0°
C22C23C24H241174.0°180.0°
C22C23H232H231119.2°120.0°
C23C22H222H221119.3°119.9°
C23C22C21H21260.3°180.0°
C23C22C21H211178.5°60.0°
C23C24C19H1968.1°60.0°
C23C24H242H241118.5°120.0°
C24C23H232H231119.1°120.0°
C24C23C22H222177.1°60.0°
C24C23C22H22163.4°180.0°
H8C8C7H71.9°0.0°
H7C7C6H61.5°0.0°
H5C5C1H10.4°0.1°
H12C12C16H162176.9°179.2°
H12C12C16H16162.8°59.2°
H12C12C13H13262.9°57.6°
H12C12C13H131178.1°177.8°
H152C15C14H14249.7°59.1°
H152C15C14H14170.6°179.2°
H151C15C14H142168.5°60.9°
H151C15C14H14148.2°59.2°
H142C14C13H13255.6°62.5°
H142C14C13H131174.6°57.6°
H141C14C13H13264.7°57.6°
H141C14C13H13154.3°177.8°
H171C17C18H181157.9°179.9°
H171C17C18H18239.7°60.0°
H172C17C18H18182.5°60.0°
H172C17C18H182159.4°180.0°
H181C18C19H19178.7°65.1°
H182C18C19H1963.1°175.0°
H19C19C24H242171.5°179.9°
H19C19C24H24152.4°60.0°
H19C19C20H20258.2°60.0°
H19C19C20H201177.1°180.0°
H242C24C23H232172.8°60.0°
H242C24C23H23153.4°180.0°
H241C24C23H23253.7°60.0°
H241C24C23H23165.7°59.9°
H232C23C22H22256.8°60.0°
H232C23C22H221176.3°60.0°
H231C23C22H22262.6°180.0°
H231C23C22H22156.9°60.0°
H222C22C21H21259.9°60.0°
H222C22C21H21161.2°180.0°
H221C22C21H212179.4°60.0°
H221C22C21H21158.3°60.0°
H212C21C20H20262.8°60.1°
H212C21C20H201178.3°60.0°
H211C21C20H20258.3°60.0°
H211C21C20H20160.6°179.9°

250835

PDB entries from 2026-03-18

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