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F0Q

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N2C8sing1.40Å1.33Å
N5N6doub1.29Å1.38ÅAromatic
N5C2sing1.33Å1.34ÅAromatic
N6Nsing1.29Å1.36ÅAromatic
C8C9doub1.39Å1.38ÅAromatic
C8C7sing1.39Å1.36ÅAromatic
C9C10sing1.38Å1.38ÅAromatic
C7C6doub1.38Å1.37ÅAromatic
C2C3sing1.51Å1.51Å
C2N7doub1.31Å1.35ÅAromatic
C3N1sing1.46Å1.46Å
NN7sing1.29Å1.39ÅAromatic
NCsing1.47Å1.48Å
C10C5doub1.38Å1.38ÅAromatic
C6C5sing1.38Å1.37ÅAromatic
C5C4sing1.51Å1.52Å
N1C4sing1.46Å1.42Å
N1C11sing1.35Å1.31Å
OC11doub1.22Å1.19Å
C11N3sing1.35Å1.25Å
C16C15sing1.55Å1.50Å
C16C17sing1.54Å1.50Å
C15C14sing1.55Å1.52Å
C14N4sing1.47Å1.45Å
O1C13doub1.21Å1.20Å
N4C13sing1.35Å1.35Å
N4C17sing1.47Å1.48Å
N3C12sing1.46Å1.46Å
C13C12sing1.51Å1.52Å
C17C18sing1.51Å1.48Å
BRC23sing1.89Å1.87Å
C18C23doub1.38Å1.36ÅAromatic
C18C19sing1.38Å1.37ÅAromatic
C23C22sing1.38Å1.37ÅAromatic
C19C20doub1.38Å1.38ÅAromatic
C22C21doub1.38Å1.36ÅAromatic
C20C21sing1.38Å1.38ÅAromatic
C4H1sing1.09Å1.10Å
C4H2sing1.09Å1.10Å
C6H3sing1.08Å1.08Å
C7H4sing1.08Å1.08Å
N2H5sing0.97Å1.00Å
N2H6sing0.97Å1.00Å
C9H7sing1.08Å1.08Å
C10H8sing1.08Å1.08Å
C3H9sing1.09Å1.10Å
C3H10sing1.09Å1.10Å
CH11sing1.09Å1.10Å
CH12sing1.09Å1.10Å
CH13sing1.09Å1.10Å
N3H14sing0.97Å1.00Å
C12H15sing1.09Å1.10Å
C12H16sing1.09Å1.10Å
C14H17sing1.09Å1.10Å
C14H18sing1.09Å1.10Å
C15H19sing1.09Å1.10Å
C15H20sing1.09Å1.10Å
C16H21sing1.09Å1.10Å
C16H22sing1.09Å1.10Å
C17H23sing1.09Å1.10Å
C19H24sing1.08Å1.08Å
C20H25sing1.08Å1.08Å
C21H26sing1.08Å1.08Å
C22H27sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N2C8C9120.9°120.0°
N2C8C7119.6°120.1°
C8N2H5109.5°120.1°
C8N2H6109.5°120.0°
N6N5C2111.8°107.3°
N5N6N102.0°108.8°
N5C2C3124.2°126.5°
N5C2N7108.8°106.9°
N6NN7112.6°109.2°
N6NC123.0°125.4°
C9C8C7119.5°119.9°
C8C9C10118.8°119.9°
C8C9H7120.6°120.0°
C8C7C6121.4°119.9°
C8C7H4119.3°120.0°
C9C10C5121.9°120.1°
C10C9H7120.6°120.1°
C9C10H8119.1°120.0°
C7C6C5120.5°120.1°
C7C6H3119.7°120.0°
C6C7H4119.3°120.0°
C3C2N7127.0°126.5°
C2C3N1111.4°109.5°
C2C3H9109.0°109.4°
C2C3H10109.0°109.5°
C2N7N104.8°107.9°
C3N1C4111.7°120.0°
C3N1C11123.5°120.0°
N1C3H9109.0°109.5°
N1C3H10109.0°109.5°
N7NC124.4°125.4°
NCH11109.5°109.5°
NCH12109.5°109.4°
NCH13109.5°109.5°
C10C5C6117.9°120.1°
C10C5C4122.3°119.9°
C5C10H8119.0°120.0°
C6C5C4119.7°119.9°
C5C6H3119.7°120.0°
C5C4N1117.5°109.5°
C5C4H1107.4°109.4°
C5C4H2107.4°109.5°
C4N1C11124.8°120.0°
N1C4H1107.4°109.5°
N1C4H2107.5°109.4°
N1C11O118.1°120.0°
N1C11N3121.1°120.0°
OC11N3120.8°120.0°
C11N3C12123.5°120.0°
C11N3H14118.2°120.0°
C15C16C17103.5°102.9°
C16C15C14106.2°101.6°
C16C15H19110.3°111.0°
C16C15H20110.3°111.0°
C15C16H21110.9°110.7°
C15C16H22111.0°110.7°
C16C17N4105.4°107.3°
C16C17C18108.7°109.8°
C17C16H21110.9°110.9°
C17C16H22110.9°110.6°
C16C17H23109.9°110.0°
C15C14N4105.4°104.8°
C15C14H17110.5°110.4°
C15C14H18110.5°110.4°
C14C15H19110.3°111.0°
C14C15H20110.3°111.1°
C14N4C13121.4°125.7°
C14N4C17110.2°108.7°
N4C14H17110.5°110.4°
N4C14H18110.5°110.4°
O1C13N4120.3°120.0°
O1C13C12118.2°120.0°
C13N4C17128.3°125.6°
N4C13C12121.5°120.0°
N4C17C18112.3°109.9°
N4C17H23110.3°109.9°
N3C12C13106.5°109.5°
C12N3H14118.2°120.0°
N3C12H15110.2°109.5°
N3C12H16110.2°109.6°
C13C12H15110.2°109.4°
C13C12H16110.2°109.5°
C17C18C23120.4°120.1°
C17C18C19120.9°120.0°
C18C17H23110.2°110.0°
BRC23C18121.6°120.0°
BRC23C22116.6°120.0°
C23C18C19118.7°120.0°
C18C23C22121.8°120.0°
C18C19C20119.7°120.0°
C18C19H24120.2°120.0°
C23C22C21119.8°120.0°
C23C22H27120.1°120.0°
C19C20C21120.7°120.0°
C20C19H24120.2°120.0°
C19C20H25119.6°120.0°
C22C21C20119.3°120.0°
C22C21H26120.4°120.0°
C21C22H27120.1°120.0°
C21C20H25119.7°120.0°
C20C21H26120.4°120.0°
H1C4H2109.5°109.5°
H5N2H6109.5°120.0°
H9C3H10109.5°109.5°
H11CH12109.5°109.4°
H11CH13109.4°109.5°
H12CH13109.5°109.5°
H15C12H16109.4°109.5°
H17C14H18109.5°110.3°
H19C15H20109.4°110.9°
H21C16H22109.5°110.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N2C8C9C7178.6°179.7°
N2C8C9C10178.8°180.0°
N2C8C7C6179.3°179.7°
N2C8C7H40.7°0.3°
C8N2H5H6120.0°180.0°
N2C8C9H71.2°0.3°
N6N5C2C3179.1°180.0°
N6N5C2N70.5°0.2°
N5N6NN71.2°0.3°
N5N6NC179.6°180.0°
C2N5N6N0.4°0.1°
N5C2C3N7179.6°179.8°
N5C2C3N1130.7°89.7°
N5C2N7N1.2°0.4°
N5C2C3H9109.0°150.3°
N5C2C3H1010.4°30.2°
N6NN7C21.6°0.5°
N6NN7C178.4°179.7°
N6NCH110.0°90.0°
N6NCH12120.0°150.1°
N6NCH13120.0°30.1°
C8C9C10H7180.0°179.8°
C9C8C7C62.1°0.1°
C8C9C10C52.7°0.5°
C9C8C7H4177.9°180.0°
C9C8N2H5180.0°0.1°
C9C8N2H660.0°180.0°
C8C9C10H8177.4°179.9°
C7C8C9C102.6°0.3°
C8C7C6H4180.0°179.9°
C8C7C6C51.5°0.1°
C8C7C6H3178.5°180.0°
C7C8N2H51.4°179.7°
C7C8N2H6121.4°0.3°
C7C8C9H7177.4°179.9°
C9C10C5H8180.0°179.5°
C9C10C5C62.1°0.6°
C9C10C5C4178.3°179.8°
C7C6C5C101.5°0.3°
C7C6C5H3180.0°179.9°
C7C6C5C4177.8°180.0°
C2C3N1H9120.3°120.0°
C2C3N1H10120.3°120.0°
C3C2N7N178.4°179.8°
C2C3N1C4122.5°90.0°
C2C3N1C1157.9°90.0°
C2C3H9H10119.2°120.0°
N7C2C3N149.7°90.0°
C2N7NC179.9°179.9°
N7C2C3H970.5°30.0°
N7C2C3H10170.0°150.0°
C3N1C4C560.3°90.0°
C3N1C4C11179.6°180.0°
C3N1C11O5.1°180.0°
C3N1C11N3175.6°0.3°
C3N1C4H160.8°30.0°
C3N1C4H2178.5°150.0°
N1C3H9H10119.1°120.0°
N7NCH11178.2°89.6°
N7NCH1261.8°30.3°
N7NCH1358.2°150.3°
NCH11H12120.0°119.9°
NCH11H13120.0°120.1°
NCH12H13120.0°120.0°
C10C5C6C4176.3°179.7°
C10C5C4N1132.8°90.3°
C10C5C4H111.7°149.7°
C10C5C4H2106.0°29.7°
C10C5C6H3178.5°179.8°
C5C10C9H7177.3°179.7°
C6C5C4N151.0°90.0°
C6C5C4H1172.2°29.9°
C6C5C4H270.1°150.0°
C5C6C7H4178.5°180.0°
C6C5C10H8177.9°179.9°
C5C4N1H1121.2°120.0°
C5C4N1H2121.1°120.0°
C5C4N1C11119.2°90.0°
C5C4H1H2116.4°120.0°
C4C5C6H32.2°0.1°
C4C5C10H81.7°0.2°
C4N1C11O175.4°0.1°
C4N1C11N33.9°179.7°
N1C4H1H2116.4°120.0°
C4N1C3H92.3°150.0°
C4N1C3H10117.2°30.0°
N1C11ON3179.3°179.6°
N1C11N3C12178.0°179.7°
C11N1C4H1119.6°150.0°
C11N1C4H21.9°30.0°
C11N1C3H9178.2°30.0°
C11N1C3H1062.4°150.0°
N1C11N3H142.0°0.4°
OC11N3C122.8°0.1°
OC11N3H14177.3°180.0°
C11N3C12H14180.0°179.9°
C11N3C12C1371.0°180.0°
C11N3C12H1548.6°60.1°
C11N3C12H16169.5°59.9°
C15C16C17H21119.0°118.4°
C15C16C17H22119.1°118.3°
C16C15C14H19119.5°118.0°
C16C15C14H20119.5°118.1°
C16C15C14N419.2°37.1°
C15C16C17N428.8°22.5°
C15C16C17C1891.8°141.9°
C16C15C14H17100.2°81.8°
C16C15C14H18138.6°155.9°
C16C15H19H20121.5°123.9°
C15C16H21H22122.8°123.3°
C15C16C17H23147.6°97.0°
C17C16C15C1429.6°35.7°
C16C17N4C1417.7°0.8°
C16C17N4C13159.0°179.1°
C16C17N4C18118.2°119.3°
C16C17N4H23118.5°119.5°
C16C17C18H23120.4°121.1°
C16C17C18C2378.1°87.3°
C16C17C18C19101.0°93.1°
C17C16C15H19149.1°153.7°
C17C16C15H2089.9°82.4°
C17C16H21H22122.8°123.2°
C15C14N4H17119.4°118.9°
C15C14N4H18119.4°118.9°
C15C14N4C13177.9°155.9°
C15C14N4C170.9°24.0°
C15C14H17H18121.9°122.3°
C14C15H19H20121.5°123.9°
C14C15C16H21148.6°82.8°
C14C15C16H2289.5°153.9°
C14N4C13O19.7°179.7°
C14N4C13C17176.4°179.8°
C14N4C13C12169.2°0.2°
C14N4C17C18100.4°118.5°
N4C14H17H18121.9°122.2°
N4C14C15H19138.7°155.1°
N4C14C15H20100.3°81.1°
C14N4C17H23136.3°120.3°
O1C13N4C12178.9°179.9°
O1C13N4C17166.7°0.1°
O1C13C12N343.4°0.1°
O1C13C12H15162.9°120.1°
O1C13C12H1676.2°120.0°
N4C13C12N3137.7°180.0°
C13N4C17C1882.9°61.6°
N4C13C12H1518.2°60.0°
N4C13C12H16102.7°59.9°
C13N4C14H1758.5°85.3°
C13N4C14H1862.8°36.9°
C13N4C17H2340.4°59.6°
C17N4C13C1214.4°180.0°
N4C17C18H23123.3°121.1°
N4C17C18C23165.7°154.9°
N4C17C18C1915.2°24.7°
C17N4C14H17118.5°94.9°
C17N4C14H18120.2°142.9°
N4C17C16H21147.8°95.9°
N4C17C16H2290.3°140.8°
N3C12C13H15119.6°120.0°
N3C12C13H16119.6°120.1°
N3C12H15H16121.4°120.1°
C13C12N3H14109.0°0.1°
C13C12H15H16121.3°120.0°
C17C18C23BR1.6°0.1°
C17C18C23C19179.1°179.6°
C17C18C23C22177.6°180.0°
C17C18C19C20178.4°180.0°
C18C17C16H2127.3°23.5°
C18C17C16H22149.2°99.8°
C17C18C19H241.6°0.0°
BRC23C18C22179.2°179.9°
BRC23C18C19177.5°179.7°
BRC23C22C21177.5°180.0°
BRC23C22H272.5°0.1°
C23C18C19C202.5°0.3°
C18C23C22C213.2°0.1°
C23C18C17H2342.4°33.8°
C23C18C19H24177.4°179.7°
C18C23C22H27176.8°180.0°
C19C18C23C223.3°0.3°
C18C19C20H24180.0°180.0°
C18C19C20C211.8°0.0°
C19C18C17H23138.6°145.8°
C18C19C20H25178.3°180.0°
C23C22C21H27180.0°179.9°
C23C22C21C202.3°0.2°
C23C22C21H26177.7°179.9°
C19C20C21C221.6°0.2°
C19C20C21H25180.0°180.0°
C19C20C21H26178.4°179.9°
C22C21C20H26180.0°179.7°
C22C21C20H25178.4°179.8°
C21C20C19H24178.2°180.0°
C20C21C22H27177.7°179.7°
H3C6C7H41.5°0.1°
H7C9C10H82.6°0.2°
H11CH12H13120.0°120.0°
H14N3C12H15131.5°120.0°
H14N3C12H1610.5°120.0°
H17C14C15H1919.3°36.2°
H17C14C15H20140.3°160.0°
H18C14C15H19101.9°86.1°
H18C14C15H2019.1°37.8°
H19C15C16H2191.8°35.2°
H19C15C16H2230.1°88.1°
H20C15C16H2129.1°159.0°
H20C15C16H22151.0°35.8°
H21C16C17H2393.4°144.6°
H22C16C17H2328.5°21.3°
H24C19C20H251.8°0.0°
H25C20C21H261.6°0.1°
H26C21C22H272.3°0.0°

222415

PDB entries from 2024-07-10

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