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A1CQZ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.51Å1.50Å
N1C2doub1.30Å1.37ÅAromatic
N1N2sing1.40Å1.35ÅAromatic
C2C22sing1.46Å1.43ÅAromatic
N2C3sing1.47Å1.44Å
N2C11sing1.37Å1.35ÅAromatic
C3C4sing1.53Å1.51Å
C4C5sing1.51Å1.52Å
C22C11doub1.41Å1.42ÅAromatic
C22C21sing1.40Å1.40ÅAromatic
C11N3sing1.33Å1.33ÅAromatic
C21C13doub1.40Å1.39ÅAromatic
C6C5doub1.38Å1.40ÅAromatic
C6C7sing1.38Å1.41ÅAromatic
C5C10sing1.38Å1.40ÅAromatic
N3C12doub1.31Å1.32ÅAromatic
C13C12sing1.40Å1.42ÅAromatic
C13C14sing1.48Å1.50Å
C7C8doub1.38Å1.40ÅAromatic
O1C14doub1.22Å1.24Å
C14N4sing1.35Å1.33Å
C10C9doub1.38Å1.41ÅAromatic
N4C15sing1.46Å1.45Å
C8C9sing1.38Å1.38ÅAromatic
C15C16sing1.51Å1.52Å
C16O2doub1.21Å1.22Å
C16N5sing1.35Å1.33Å
C20N5sing1.47Å1.46Å
C20C19sing1.55Å1.52Å
N5C17sing1.47Å1.48Å
C19C18sing1.55Å1.48Å
C17C18sing1.54Å1.51Å
C1H2sing1.09Å1.10Å
C1H3sing1.09Å1.10Å
C1H1sing1.09Å1.10Å
C3H4sing1.09Å1.10Å
C3H5sing1.09Å1.10Å
C4H6sing1.09Å1.10Å
C4H7sing1.09Å1.10Å
N4H14sing0.97Å1.00Å
C6H8sing1.08Å1.08Å
C7H9sing1.08Å1.08Å
C8H10sing1.08Å1.08Å
C9H11sing1.08Å1.08Å
C10H12sing1.08Å1.08Å
C12H13sing1.08Å1.08Å
C15H15sing1.09Å1.10Å
C15H16sing1.09Å1.10Å
C17H17sing1.09Å1.10Å
C17H18sing1.09Å1.10Å
C18H20sing1.09Å1.10Å
C18H19sing1.09Å1.10Å
C19H22sing1.09Å1.10Å
C19H21sing1.09Å1.10Å
C20H24sing1.09Å1.10Å
C20H23sing1.09Å1.10Å
C21CL1sing1.74Å1.97Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1C2N1120.0°126.2°
C1C2C22131.5°126.2°
C2C1H2109.5°109.5°
C2C1H3109.4°109.5°
C2C1H1109.5°109.5°
C2N1N2107.3°110.1°
N1C2C22108.5°107.6°
N1N2C3121.9°125.4°
N1N2C11111.8°109.3°
C2C22C11105.1°106.5°
C2C22C21138.9°134.1°
C3N2C11126.2°125.3°
N2C3C4115.6°109.4°
N2C3H4107.9°109.5°
N2C3H5107.9°109.4°
N2C11C22107.4°106.5°
N2C11N3127.2°133.2°
C3C4C5111.8°109.5°
C4C3H4107.9°109.5°
C4C3H5107.9°109.5°
C3C4H6108.9°109.5°
C3C4H7108.9°109.5°
C4C5C6121.6°120.0°
C4C5C10120.5°120.0°
C5C4H6108.9°109.5°
C5C4H7108.9°109.4°
C11C22C21116.1°119.4°
C22C11N3125.3°120.2°
C22C21C13120.4°117.9°
C22C21CL1119.4°121.0°
C11N3C12116.3°121.9°
C21C13C12116.5°119.2°
C21C13C14121.8°120.4°
C13C21CL1119.3°121.0°
C5C6C7120.5°120.0°
C6C5C10117.8°120.0°
C5C6H8119.8°120.0°
C6C7C8121.2°120.0°
C7C6H8119.7°120.0°
C6C7H9119.4°120.0°
C5C10C9121.2°120.0°
C5C10H12119.4°120.0°
N3C12C13125.0°121.4°
N3C12H13117.5°119.3°
C12C13C14121.3°120.4°
C13C12H13117.5°119.3°
C13C14O1126.3°120.0°
C13C14N4113.1°120.0°
C7C8C9118.6°120.0°
C8C7H9119.4°119.9°
C7C8H10120.7°120.0°
O1C14N4120.6°120.0°
C14N4C15123.7°120.0°
C14N4H14118.2°120.0°
C10C9C8120.6°120.0°
C10C9H11119.7°120.0°
C9C10H12119.4°120.0°
N4C15C16113.9°109.5°
C15N4H14118.1°120.0°
N4C15H15108.4°109.5°
N4C15H16108.3°109.4°
C9C8H10120.7°120.0°
C8C9H11119.7°120.0°
C15C16O2121.2°120.0°
C15C16N5120.1°120.0°
C16C15H15108.3°109.5°
C16C15H16108.4°109.5°
O2C16N5118.7°120.0°
C16N5C20127.2°125.7°
C16N5C17123.1°125.7°
N5C20C19103.7°104.8°
C20N5C17109.7°108.7°
N5C20H24110.9°110.4°
N5C20H23110.9°110.4°
C20C19C18109.8°101.5°
C20C19H22109.4°111.2°
C20C19H21109.4°110.9°
C19C20H24110.9°110.7°
C19C20H23110.9°110.2°
N5C17C18106.4°107.3°
N5C17H17110.3°109.9°
N5C17H18110.3°109.9°
C19C18C17102.2°103.0°
C19C18H20111.3°110.7°
C19C18H19111.3°110.9°
C18C19H22109.4°111.0°
C18C19H21109.4°111.0°
C18C17H17110.2°109.9°
C18C17H18110.2°109.9°
C17C18H20111.3°110.7°
C17C18H19111.3°110.7°
H2C1H3109.4°109.5°
H2C1H1109.4°109.5°
H3C1H1109.5°109.5°
H4C3H5109.5°109.5°
H6C4H7109.5°109.5°
H15C15H16109.5°109.5°
H17C17H18109.5°110.0°
H20C18H19109.5°110.6°
H22C19H21109.5°110.9°
H24C20H23109.5°110.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C1C2N1C22177.4°180.0°
C1C2N1N2179.2°180.0°
C1C2C22C11178.0°180.0°
C1C2C22C211.5°0.1°
C2C1H2H3120.0°120.0°
C2C1H2H1120.0°120.0°
C2C1H3H1120.0°120.0°
C2N1N2C3177.4°180.0°
C2N1N2C112.0°0.0°
N1C2C22C111.1°0.0°
N1C2C22C21178.5°179.9°
N1C2C1H20.0°90.0°
N1C2C1H3120.0°150.0°
N1C2C1H1120.0°30.0°
N2N1C2C221.9°0.0°
N1N2C3C11174.7°179.9°
N1N2C3C436.5°90.0°
N1N2C11C221.3°0.0°
N1N2C11N3175.2°180.0°
N1N2C3H4157.4°150.0°
N1N2C3H584.4°30.0°
C2C22C11N20.1°0.0°
C2C22C11C21179.7°180.0°
C2C22C11N3176.4°180.0°
C2C22C21C13174.7°180.0°
C22C2C1H2176.7°90.0°
C22C2C1H363.4°30.0°
C22C2C1H156.6°150.0°
C2C22C21CL15.4°0.1°
N2C3C4H4120.9°120.0°
N2C3C4H5120.9°119.9°
N2C3C4C5130.8°180.0°
C3N2C11C22176.4°180.0°
C3N2C11N30.0°0.1°
N2C3H4H5117.2°120.0°
N2C3C4H6108.9°60.0°
N2C3C4H710.4°60.1°
C11N2C3C4138.2°90.1°
N2C11C22N3176.5°179.9°
N2C11C22C21179.8°180.0°
N2C11N3C12173.7°180.0°
C11N2C3H417.3°30.0°
C11N2C3H5100.9°150.0°
C3C4C5H6120.3°120.0°
C3C4C5H7120.3°120.0°
C3C4C5C6109.8°89.7°
C3C4C5C1068.1°90.0°
C4C3H4H5117.2°120.0°
C3C4H6H7118.9°120.0°
C4C5C6C10178.0°179.7°
C4C5C6C7179.6°180.0°
C4C5C10C9179.8°179.8°
C5C4C3H49.9°60.0°
C5C4C3H5108.4°60.1°
C5C4H6H7118.9°120.0°
C4C5C6H80.5°0.1°
C4C5C10H120.2°0.0°
C11C22C21C134.8°0.1°
C22C11N3C122.1°0.1°
C11C22C21CL1174.1°180.0°
C21C22C11N33.2°0.1°
C22C21C13CL1169.3°179.9°
C22C21C13C121.3°0.1°
C22C21C13C14171.4°180.0°
C11N3C12C136.3°0.1°
C11N3C12H13173.7°179.9°
C21C13C12N34.6°0.1°
C21C13C12C14172.8°179.9°
C21C13C14O1102.9°0.1°
C21C13C14N477.0°179.9°
C21C13C12H13175.4°179.9°
C5C6C7H8180.0°179.9°
C5C6C7C80.4°0.1°
C6C5C10C91.8°0.5°
C6C5C4H610.6°150.3°
C6C5C4H7129.9°30.3°
C5C6C7H9179.6°180.0°
C6C5C10H12178.2°179.7°
C7C6C5C101.6°0.3°
C6C7C8H9180.0°180.0°
C6C7C8C90.7°0.0°
C6C7C8H10179.3°180.0°
C5C10C9H12180.0°179.9°
C5C10C9C80.7°0.4°
C10C5C4H6171.5°30.0°
C10C5C4H752.2°150.0°
C10C5C6H8178.4°179.7°
C5C10C9H11179.3°179.7°
N3C12C13H13180.0°180.0°
N3C12C13C14177.4°180.0°
C12C13C14O184.7°180.0°
C12C13C14N495.4°0.0°
C12C13C21CL1170.6°180.0°
C13C14O1N4179.9°180.0°
C13C14N4C15179.8°179.9°
C13C14N4H140.2°0.0°
C14C13C12H132.6°0.0°
C14C13C21CL12.1°0.1°
C7C8C9C100.5°0.1°
C7C8C9H10180.0°180.0°
C8C7C6H8179.7°180.0°
C7C8C9H11179.5°179.9°
O1C14N4C150.3°0.0°
O1C14N4H14179.7°179.9°
C14N4C15H14180.0°179.9°
C14N4C15C16162.2°180.0°
C14N4C15H1577.2°59.9°
C14N4C15H1641.5°60.0°
C10C9C8H11180.0°179.9°
C10C9C8H10179.5°179.9°
N4C15C16H15120.6°120.0°
N4C15C16H16120.7°120.0°
N4C15C16O29.9°0.0°
N4C15C16N5171.2°180.0°
N4C15H15H16118.0°119.9°
C9C8C7H9179.3°179.9°
C8C9C10H12179.3°179.8°
C15C16O2N5179.0°180.0°
C15C16N5C207.4°0.3°
C15C16N5C17174.0°180.0°
C16C15N4H1417.8°0.1°
C16C15H15H16118.0°120.0°
O2C16N5C20173.6°179.7°
O2C16N5C175.0°0.1°
O2C16C15H15130.5°120.0°
O2C16C15H16110.8°120.0°
C16N5C20C17178.8°179.7°
C16N5C20C19174.7°155.8°
C16N5C17C18158.2°179.0°
N5C16C15H1550.5°60.0°
N5C16C15H1668.2°60.0°
C16N5C17H1782.3°59.6°
C16N5C17H1838.7°61.6°
C16N5C20H2455.5°85.0°
C16N5C20H2366.3°37.3°
N5C20C19H24119.1°118.9°
N5C20C19H23119.1°118.7°
N5C20C19C1814.5°37.3°
C20N5C17C1820.6°1.3°
C20N5C17H1798.8°120.7°
C20N5C17H18140.1°118.2°
N5C20C19H22134.6°80.8°
N5C20C19H21105.5°155.3°
N5C20H24H23122.7°122.3°
C19C20N5C174.1°24.5°
C20C19C18H22120.1°118.2°
C20C19C18H21120.0°117.9°
C20C19C18C1726.4°35.6°
C20C19C18H2092.4°154.0°
C20C19C18H19145.2°82.8°
C20C19H22H21119.8°123.9°
C19C20H24H23122.6°122.2°
N5C17C18C1928.1°22.2°
N5C17C18H17119.5°119.4°
N5C17C18H18119.5°119.4°
N5C17H17H18121.5°121.1°
N5C17C18H2090.7°140.6°
N5C17C18H19147.0°96.4°
C17N5C20H24123.2°94.7°
C17N5C20H23115.0°143.0°
C19C18C17H20118.8°118.4°
C19C18C17H19118.8°118.5°
C19C18C17H1791.4°97.2°
C19C18C17H18147.7°141.6°
C19C18H20H19123.4°123.3°
C18C19H22H21119.9°123.9°
C18C19C20H24104.6°81.7°
C18C19C20H23133.6°156.0°
C18C17H17H18121.4°121.1°
C17C18H20H19123.4°123.1°
C17C18C19H22146.5°82.6°
C17C18C19H2193.6°153.6°
H2C1H3H1120.0°120.0°
H4C3C4H6130.2°180.0°
H4C3C4H7110.5°59.9°
H5C3C4H612.0°60.0°
H5C3C4H7131.3°180.0°
H14N4C15H15102.8°120.0°
H14N4C15H16138.5°120.1°
H8C6C7H90.4°0.0°
H9C7C8H100.7°0.1°
H10C8C9H110.5°0.1°
H11C9C10H120.7°0.2°
H17C17C18H20149.8°21.2°
H17C17C18H1927.4°144.2°
H18C17C18H2028.8°100.0°
H18C17C18H1993.5°23.1°
H20C18C19H2227.6°35.9°
H20C18C19H21147.5°88.0°
H19C18C19H2294.7°159.0°
H19C18C19H2125.2°35.2°
H22C19C20H2415.5°160.3°
H22C19C20H23106.3°37.9°
H21C19C20H24135.4°36.4°
H21C19C20H2313.6°86.0°

248335

PDB entries from 2026-01-28

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