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5T0

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OC4doub1.21Å1.24Å
C3C2sing1.55Å1.51Å
C3Nsing1.48Å1.47Å
C2C1sing1.55Å1.52Å
C4Nsing1.35Å1.35Å
C4C5sing1.51Å1.52Å
NCsing1.47Å1.47Å
C6C5sing1.53Å1.53Å
C6C7sing1.53Å1.53Å
C8C9sing1.53Å1.53Å
C8C7sing1.53Å1.52Å
C1Csing1.54Å1.52Å
C9N1sing1.47Å1.47Å
C7C11sing1.53Å1.54Å
C11C10sing1.53Å1.53Å
N1C12sing1.40Å1.42Å
N1C10sing1.47Å1.48Å
C12C13doub1.39Å1.40ÅAromatic
C12C17sing1.39Å1.41ÅAromatic
C13C14sing1.38Å1.40ÅAromatic
C17C16doub1.38Å1.40ÅAromatic
C14C15doub1.38Å1.40ÅAromatic
C16C15sing1.38Å1.40ÅAromatic
C15C18sing1.51Å1.51Å
C18N2sing1.47Å1.45Å
N2C19sing1.47Å1.45Å
C14H1sing1.08Å1.08Å
C13H2sing1.08Å1.08Å
C17H3sing1.08Å1.08Å
C16H4sing1.08Å1.08Å
C8H5sing1.09Å1.10Å
C8H6sing1.09Å1.10Å
C10H7sing1.09Å1.10Å
C10H8sing1.09Å1.10Å
C9H9sing1.09Å1.10Å
C9H10sing1.09Å1.10Å
C11H11sing1.09Å1.10Å
C11H12sing1.09Å1.10Å
C1H13sing1.09Å1.10Å
C2H14sing1.09Å1.10Å
C3H15sing1.09Å1.10Å
C5H16sing1.09Å1.10Å
C5H17sing1.09Å1.10Å
C6H18sing1.09Å1.10Å
C6H19sing1.09Å1.10Å
C7H20sing1.09Å1.10Å
CH21sing1.09Å1.10Å
C18H22sing1.09Å1.10Å
C18H23sing1.09Å1.10Å
N2H24sing1.01Å1.00Å
C19H26sing1.09Å1.10Å
C19H27sing1.09Å1.10Å
C19H28sing1.09Å1.10Å
C1H29sing1.09Å1.10Å
C2H30sing1.09Å1.10Å
C3H31sing1.09Å1.10Å
CH32sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OC4N121.1°120.0°
OC4C5120.9°120.0°
C2C3N105.6°104.8°
C3C2C1106.6°101.6°
C3C2H14110.2°111.0°
C2C3H15110.4°110.4°
C3C2H30110.2°111.0°
C2C3H31110.4°110.4°
C3NC4122.4°125.6°
C3NC113.8°108.7°
NC3H15110.4°110.3°
NC3H31110.4°110.4°
C2C1C108.9°102.9°
C2C1H13109.6°110.7°
C1C2H14110.2°111.0°
C2C1H29109.6°110.9°
C1C2H30110.2°111.0°
NC4C5118.0°120.0°
C4NC123.8°125.7°
C4C5C6112.7°109.5°
C4C5H16108.7°109.5°
C4C5H17108.7°109.5°
NCC1104.1°107.3°
NCH21110.8°109.8°
NCH32110.8°109.9°
C5C6C7116.9°109.5°
C6C5H16108.7°109.5°
C6C5H17108.6°109.5°
C5C6H18107.6°109.5°
C5C6H19107.6°109.4°
C6C7C8101.3°109.5°
C6C7C11112.0°109.5°
C7C6H18107.6°109.5°
C7C6H19107.6°109.5°
C6C7H20111.3°109.5°
C9C8C7117.8°109.3°
C8C9N1113.0°109.6°
C9C8H5107.4°109.5°
C9C8H6107.4°109.5°
C8C9H9108.6°109.4°
C8C9H10108.6°109.5°
C8C7C11109.4°109.2°
C7C8H5107.4°109.6°
C7C8H6107.4°109.6°
C8C7H20111.4°109.6°
CC1H13109.6°110.7°
C1CH21110.8°109.9°
CC1H29109.6°110.7°
C1CH32110.8°109.9°
C9N1C12117.4°111.0°
C9N1C10122.1°111.2°
N1C9H9108.6°109.4°
N1C9H10108.6°109.5°
C7C11C10111.8°109.3°
C7C11H11108.9°109.5°
C7C11H12108.9°109.6°
C11C7H20111.1°109.5°
C11C10N1110.4°109.6°
C11C10H7109.2°109.5°
C11C10H8109.3°109.4°
C10C11H11108.9°109.4°
C10C11H12108.9°109.5°
C12N1C10120.1°111.0°
N1C12C13121.5°120.1°
N1C12C17120.1°120.1°
N1C10H7109.2°109.5°
N1C10H8109.2°109.5°
C13C12C17118.4°119.8°
C12C13C14121.4°119.9°
C12C13H2119.3°120.1°
C12C17C16120.8°119.9°
C12C17H3119.6°120.0°
C13C14C15119.6°120.1°
C13C14H1120.2°120.0°
C14C13H2119.3°120.0°
C17C16C15119.9°120.1°
C16C17H3119.6°120.0°
C17C16H4120.1°120.0°
C14C15C16119.9°120.1°
C14C15C18119.7°119.9°
C15C14H1120.2°119.9°
C16C15C18120.4°119.9°
C15C16H4120.0°120.0°
C15C18N2110.7°109.4°
C15C18H22109.1°109.5°
C15C18H23109.1°109.5°
C18N2C19120.2°111.0°
N2C18H22109.2°109.5°
N2C18H23109.1°109.5°
C18N2H24106.7°111.0°
C19N2H24106.7°110.9°
N2C19H26109.5°109.4°
N2C19H27109.5°109.4°
N2C19H28109.4°109.5°
H5C8H6109.4°109.5°
H7C10H8109.5°109.4°
H9C9H10109.4°109.4°
H11C11H12109.5°109.5°
H13C1H29109.5°110.7°
H14C2H30109.4°110.9°
H15C3H31109.5°110.5°
H16C5H17109.5°109.5°
H18C6H19109.5°109.4°
H21CH32109.5°110.0°
H22C18H23109.5°109.5°
H26C19H27109.4°109.5°
H26C19H28109.5°109.5°
H27C19H28109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OC4NC36.5°0.0°
OC4NC5177.7°180.0°
OC4NC174.9°180.0°
OC4C5C63.8°0.0°
OC4C5H16116.7°120.0°
OC4C5H17124.2°120.0°
C2C3NH15119.4°118.8°
C2C3NH31119.4°118.9°
C3C2C1H14119.6°118.1°
C3C2C1H30119.6°118.1°
C2C3NC4175.2°155.8°
C2C3NC3.5°24.1°
C3C2C1C10.3°35.5°
C3C2C1H13109.6°153.8°
C3C2H14H30121.3°123.9°
C2C3H15H31121.8°122.3°
C3C2C1H29130.3°82.9°
NC3C2C18.3°37.0°
C3NC4C178.6°179.9°
C3NC4C5171.2°180.0°
C3NCC12.8°1.0°
NC3C2H14127.9°155.1°
NC3H15H31121.8°122.3°
C3NCH21116.4°120.5°
NC3C2H30111.3°81.1°
C3NCH32121.9°118.4°
C2C1CN8.0°22.2°
C2C1CH13119.9°118.3°
C2C1CH29119.9°118.5°
C2C1H13H29120.3°123.3°
C1C2H14H30121.3°123.9°
C1C2C3H15127.7°81.8°
C2C1CH21111.1°97.2°
C1C2C3H31111.1°155.9°
C2C1CH32127.2°141.6°
NC4C5C6173.9°180.0°
C4NCC1178.6°178.9°
C4NC3H1555.8°85.4°
NC4C5H1665.6°60.0°
NC4C5H1753.5°60.0°
C4NCH2162.3°59.4°
C4NC3H3165.5°37.0°
C4NCH3259.4°61.7°
C5C4NC7.4°0.0°
C4C5C6H16120.5°120.0°
C4C5C6H17120.5°120.0°
C4C5C6C7177.5°180.0°
C4C5H16H17118.6°120.0°
C4C5C6H1861.4°60.0°
C4C5C6H1956.4°60.0°
NCC1H21119.2°119.4°
NCC1H32119.1°119.4°
NCC1H13111.9°140.5°
CNC3H15122.9°94.7°
NCH21H32122.5°121.0°
NCC1H29128.0°96.3°
CNC3H31115.9°143.0°
C5C6C7H18121.1°120.0°
C5C6C7H19121.1°120.0°
C5C6C7C8170.3°175.0°
C5C6C7C1173.3°65.3°
C6C5H16H17118.5°120.0°
C5C6H18H19116.6°119.9°
C5C6C7H2051.8°54.8°
C6C7C8C9165.1°177.5°
C6C7C8C11118.3°119.9°
C6C7C8H20118.4°120.2°
C6C7C11H20125.2°120.1°
C6C7C11C10168.8°177.5°
C6C7C8H573.7°62.5°
C6C7C8H643.9°57.6°
C6C7C11H1170.9°57.7°
C6C7C11H1248.4°62.5°
C7C6C5H1657.0°60.0°
C7C6C5H1762.0°60.0°
C7C6H18H19116.6°120.0°
C9C8C7H5121.2°119.9°
C9C8C7H6121.2°119.9°
C8C9N1H9120.6°120.0°
C8C9N1H10120.6°120.1°
C9C8C7C1146.7°57.7°
C8C9N1C12156.2°174.1°
C8C9N1C1031.3°61.7°
C9C8H5H6116.2°120.0°
C8C9H9H10118.4°120.0°
C9C8C7H2076.5°62.3°
C7C8C9N132.9°59.2°
C8C7C11H20123.4°120.0°
C8C7C11C1057.3°57.6°
C7C8H5H6116.2°120.2°
C7C8C9H9153.5°179.2°
C7C8C9H1087.6°60.9°
C8C7C11H11177.7°62.2°
C8C7C11H1263.0°177.6°
C8C7C6H1868.7°65.0°
C8C7C6H1949.2°55.0°
CC1H13H29120.2°123.2°
CC1C2H14129.9°153.6°
C1CH21H32122.5°121.1°
CC1C2H30109.2°82.6°
C9N1C10C1142.8°61.7°
C9N1C12C10172.6°124.2°
C9N1C12C13143.8°180.0°
C9N1C12C1739.4°0.6°
N1C9C8H5154.2°179.2°
N1C9C8H688.3°60.8°
C9N1C10H777.3°178.2°
C9N1C10H8162.9°58.3°
N1C9H9H10118.3°119.9°
C7C11C10H11120.4°119.9°
C7C11C10H12120.3°120.0°
C7C11C10N154.8°59.1°
C11C7C8H5167.9°177.6°
C11C7C8H674.5°62.2°
C7C11C10H765.3°179.2°
C7C11C10H8175.0°60.9°
C7C11H11H12118.9°120.2°
C11C7C6H1847.8°54.7°
C11C7C6H19165.7°174.7°
C11C10N1C12145.0°174.2°
C11C10N1H7120.1°120.1°
C11C10N1H8120.2°120.0°
C11C10H7H8119.6°119.9°
C10C11H11H12118.9°120.0°
C10C11C7H2066.1°62.4°
N1C12C13C17176.9°179.4°
N1C12C13C14176.8°180.0°
N1C12C17C16177.0°179.7°
N1C12C13H23.2°0.0°
N1C12C17H33.0°0.3°
C12N1C10H794.9°54.1°
C12N1C10H824.8°65.9°
C12N1C9H935.6°54.1°
C12N1C9H1083.2°65.8°
C10N1C12C1343.6°55.8°
C10N1C12C17133.2°124.8°
N1C10H7H8119.6°120.0°
C10N1C9H9151.9°178.3°
C10N1C9H1089.2°58.4°
N1C10C11H11175.2°60.8°
N1C10C11H1265.5°179.2°
C12C13C14H2180.0°180.0°
C13C12C17C160.1°0.9°
C12C13C14C150.4°0.1°
C12C13C14H1179.6°179.8°
C13C12C17H3179.9°179.8°
C17C12C13C140.1°0.6°
C12C17C16H3180.0°179.3°
C12C17C16C150.1°0.6°
C17C12C13H2179.9°179.4°
C12C17C16H4179.9°180.0°
C13C14C15H1180.0°179.8°
C13C14C15C160.6°0.2°
C13C14C15C18178.4°179.7°
C17C16C15C140.4°0.1°
C17C16C15H4180.0°179.4°
C17C16C15C18178.6°180.0°
C14C15C16C18179.0°179.9°
C14C15C18N298.4°90.0°
C15C14C13H2179.6°179.9°
C14C15C16H4179.6°179.5°
C14C15C18H2221.8°150.0°
C14C15C18H23141.4°29.9°
C16C15C18N282.6°90.0°
C16C15C14H1179.4°180.0°
C15C16C17H3179.9°180.0°
C16C15C18H22157.2°30.0°
C16C15C18H2337.6°150.0°
C15C18N2H22120.2°120.0°
C15C18N2H23120.2°120.0°
C15C18N2C1994.3°180.0°
C18C15C14H11.6°0.1°
C18C15C16H41.4°0.6°
C15C18H22H23119.4°120.0°
C15C18N2H2427.2°56.1°
C18N2C19H24121.5°123.9°
N2C18H22H23119.4°120.0°
C18N2C19H26180.0°60.0°
C18N2C19H2760.0°180.0°
C18N2C19H2860.0°60.0°
C19N2C18H22145.6°60.0°
C19N2C18H2325.9°60.0°
N2C19H26H27120.0°120.0°
N2C19H26H28120.0°120.0°
N2C19H27H28120.0°120.0°
H1C14C13H20.4°0.2°
H3C17C16H40.1°0.6°
H5C8C9H985.3°60.8°
H5C8C9H1033.6°59.1°
H5C8C7H2044.7°57.6°
H6C8C9H932.3°59.2°
H6C8C9H10151.2°179.2°
H6C8C7H20162.3°177.8°
H7C10C11H1155.1°59.3°
H7C10C11H12174.4°60.7°
H8C10C11H1164.7°179.2°
H8C10C11H1254.6°59.2°
H11C11C7H2054.3°177.8°
H12C11C7H20173.6°57.6°
H13C1C2H1410.0°88.1°
H13C1CH21128.9°21.1°
H13C1C2H30130.9°35.7°
H13C1CH327.3°100.1°
H14C2C3H15112.7°36.3°
H14C2C1H29110.2°35.2°
H14C2C3H318.5°86.1°
H15C3C2H308.1°160.2°
H16C5C6H18178.1°180.0°
H16C5C6H1964.0°60.0°
H17C5C6H1859.0°60.0°
H17C5C6H19176.9°180.0°
H18C6C7H20172.9°174.8°
H19C6C7H2069.2°65.2°
H21CC1H298.8°144.3°
H22C18N2H2492.9°176.1°
H23C18N2H24147.4°63.9°
H24N2C19H2658.5°63.9°
H24N2C19H27178.5°56.1°
H24N2C19H2861.5°176.1°
H26C19H27H28120.0°120.0°
H29C1C2H3010.7°159.0°
H29C1CH32112.9°23.1°
H30C2C3H31129.4°37.8°

219869

PDB entries from 2024-05-15

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