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A1L

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N9N8trip1.03Å1.15Å
N8N7sing1.25Å1.15Å
N7C10sing1.47Å1.48Å
C9N6sing1.47Å1.49Å
C10C3sing1.51Å1.56Å
O1C3doub1.21Å1.23Å
O3C8doub1.22Å1.24Å
C3N2sing1.35Å1.33Å
N6C8sing1.35Å1.34Å
C16C17doub1.38Å1.39ÅAromatic
C16C15sing1.38Å1.40ÅAromatic
C23C22doub1.38Å1.39ÅAromatic
C23C24sing1.38Å1.40ÅAromatic
C8N4sing1.35Å1.36Å
C17C18sing1.38Å1.39ÅAromatic
C22C21sing1.38Å1.40ÅAromatic
C15C14doub1.38Å1.40ÅAromatic
N2C2sing1.47Å1.49Å
N5C7doub1.30Å1.36Å
C24C13doub1.38Å1.41ÅAromatic
N4C7sing1.38Å1.35Å
C18C19doub1.38Å1.40ÅAromatic
C7N3sing1.37Å1.34Å
C21C20doub1.38Å1.41ÅAromatic
C2C1sing1.51Å1.53Å
C2C4sing1.53Å1.53Å
C14C19sing1.38Å1.40ÅAromatic
C14C11sing1.51Å1.56Å
O2C1doub1.21Å1.23Å
C13C20sing1.38Å1.40ÅAromatic
C13C12sing1.51Å1.56Å
C5C4sing1.53Å1.52Å
C5C6sing1.53Å1.50Å
C1N1sing1.35Å1.35Å
N3C6sing1.47Å1.47Å
N1C11sing1.47Å1.48Å
N1C12sing1.46Å1.49Å
C9H1sing1.09Å1.10Å
C9H2sing1.09Å1.10Å
C9H3sing1.09Å1.10Å
N6H4sing0.97Å1.00Å
N4H5sing0.97Å1.00Å
N5H6sing0.97Å1.00Å
N3H7sing0.97Å1.00Å
C6H8sing1.09Å1.10Å
C6H9sing1.09Å1.10Å
C5H10sing1.09Å1.10Å
C5H11sing1.09Å1.10Å
C4H12sing1.09Å1.10Å
C4H13sing1.09Å1.10Å
C2H14sing1.09Å1.10Å
N2H15sing0.97Å1.00Å
C10H16sing1.09Å1.10Å
C10H17sing1.09Å1.10Å
C12H19sing1.09Å1.10Å
C12H20sing1.09Å1.10Å
C20H21sing1.08Å1.08Å
C21H22sing1.08Å1.08Å
C22H23sing1.08Å1.08Å
C23H24sing1.08Å1.08Å
C24H25sing1.08Å1.08Å
C11H26sing1.09Å1.10Å
C11H27sing1.09Å1.10Å
C15H28sing1.08Å1.08Å
C16H29sing1.08Å1.08Å
C17H30sing1.08Å1.08Å
C18H31sing1.08Å1.08Å
C19H32sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N9N8N7168.4°179.9°
N8N7C10118.1°120.0°
N7C10C3109.5°109.4°
N7C10H16109.4°109.4°
N7C10H17109.5°109.4°
C9N6C8120.1°120.0°
N6C9H1109.5°109.5°
N6C9H2109.5°109.5°
N6C9H3109.5°109.5°
C9N6H4120.0°120.0°
C10C3O1122.1°120.0°
C10C3N2114.7°120.0°
C3C10H16109.5°109.5°
C3C10H17109.5°109.5°
O1C3N2123.2°120.0°
O3C8N6124.9°120.0°
O3C8N4120.4°120.0°
C3N2C2127.4°120.0°
C3N2H15116.3°120.0°
N6C8N4114.7°120.0°
C8N6H4119.9°120.0°
C17C16C15120.3°120.0°
C16C17C18119.7°120.0°
C17C16H29119.8°120.0°
C16C17H30120.1°120.0°
C16C15C14120.6°120.0°
C16C15H28119.7°120.0°
C15C16H29119.9°120.0°
C22C23C24118.8°120.0°
C23C22C21119.3°120.0°
C23C22H23120.4°120.0°
C22C23H24120.6°120.0°
C23C24C13122.4°120.0°
C24C23H24120.6°120.0°
C23C24H25118.8°120.0°
C8N4C7126.9°120.0°
C8N4H5116.5°120.0°
C17C18C19119.9°120.0°
C18C17H30120.1°120.0°
C17C18H31120.0°120.0°
C22C21C20121.8°120.0°
C22C21H22119.1°120.0°
C21C22H23120.3°120.0°
C15C14C19118.5°120.0°
C15C14C11122.0°120.0°
C14C15H28119.7°119.9°
N2C2C1113.0°109.5°
N2C2C4103.7°109.4°
N2C2H14110.3°109.5°
C2N2H15116.3°120.0°
N5C7N4122.9°120.0°
N5C7N3122.2°120.0°
C7N5H6112.0°120.1°
C24C13C20118.3°120.0°
C24C13C12120.7°120.0°
C13C24H25118.8°120.0°
N4C7N3114.9°120.0°
C7N4H5116.6°120.0°
C18C19C14121.0°120.0°
C19C18H31120.1°120.0°
C18C19H32119.5°120.0°
C7N3C6125.4°120.0°
C7N3H7117.3°120.0°
C21C20C13119.4°120.0°
C21C20H21120.3°120.0°
C20C21H22119.1°120.0°
C1C2C4110.1°109.5°
C2C1O2119.4°120.0°
C2C1N1117.2°120.0°
C1C2H14109.7°109.5°
C2C4C5104.2°109.4°
C2C4H12110.8°109.5°
C2C4H13110.8°109.5°
C4C2H14109.8°109.5°
C19C14C11119.4°120.0°
C14C19H32119.5°120.0°
C14C11N1114.9°109.5°
C14C11H26108.1°109.5°
C14C11H27108.1°109.5°
O2C1N1123.4°120.0°
C20C13C12121.0°120.0°
C13C20H21120.3°120.0°
C13C12N1110.1°109.5°
C13C12H19109.3°109.5°
C13C12H20109.3°109.5°
C4C5C6113.2°109.4°
C4C5H10108.5°109.5°
C4C5H11108.5°109.5°
C5C4H12110.8°109.4°
C5C4H13110.7°109.5°
C5C6N3108.5°109.5°
C5C6H8109.7°109.5°
C5C6H9109.7°109.5°
C6C5H10108.5°109.5°
C6C5H11108.5°109.4°
C1N1C11122.2°120.0°
C1N1C12119.7°120.0°
C6N3H7117.3°120.0°
N3C6H8109.7°109.5°
N3C6H9109.7°109.4°
C11N1C12118.1°120.0°
N1C11H26108.1°109.4°
N1C11H27108.1°109.5°
N1C12H19109.3°109.5°
N1C12H20109.3°109.5°
H1C9H2109.5°109.5°
H1C9H3109.5°109.5°
H2C9H3109.5°109.4°
H8C6H9109.5°109.4°
H10C5H11109.5°109.6°
H12C4H13109.5°109.5°
H16C10H17109.5°109.5°
H19C12H20109.5°109.4°
H26C11H27109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N9N8N7C10158.9°52.0°
N8N7C10C3147.0°180.0°
N8N7C10H1627.0°60.0°
N8N7C10H1793.0°60.0°
N7C10C3H16120.0°120.0°
N7C10C3H17120.0°120.0°
N7C10C3O110.2°0.0°
N7C10C3N2169.0°180.0°
N7C10H16H17120.0°119.9°
C9N6C8O30.2°0.0°
C9N6C8H4180.0°179.9°
C9N6C8N4178.6°180.0°
N6C9H1H2120.0°120.0°
N6C9H1H3120.0°120.0°
N6C9H2H3120.0°120.0°
C10C3O1N2179.2°180.0°
C10C3N2C2178.0°180.0°
C10C3N2H152.0°0.0°
C3C10H16H17120.0°120.1°
O1C3N2C22.8°0.0°
O1C3N2H15177.2°180.0°
O1C3C10H16109.8°120.0°
O1C3C10H17130.2°119.9°
O3C8N6N4178.4°180.0°
O3C8N4C72.3°0.1°
O3C8N6H4179.8°179.9°
O3C8N4H5177.8°180.0°
C3N2C2H15180.0°180.0°
C3N2C2C162.2°60.0°
C3N2C2C4178.5°60.0°
C3N2C2H1461.0°179.9°
N2C3C10H1671.0°60.0°
N2C3C10H1749.0°60.0°
N6C8N4C7179.3°180.0°
C8N6C9H1180.0°60.0°
C8N6C9H260.0°180.0°
C8N6C9H360.0°60.1°
N6C8N4H50.7°0.0°
C17C16C15H29180.0°180.0°
C16C17C18H30180.0°180.0°
C17C16C15C140.3°0.0°
C16C17C18C190.0°0.0°
C17C16C15H28179.7°180.0°
C16C17C18H31180.0°180.0°
C15C16C17C180.0°0.0°
C16C15C14H28180.0°180.0°
C16C15C14C190.5°0.1°
C16C15C14C11179.4°179.7°
C15C16C17H30179.9°180.0°
C22C23C24H24180.0°179.6°
C23C22C21H23180.0°180.0°
C22C23C24C130.1°0.6°
C23C22C21C200.5°0.0°
C23C22C21H22179.5°180.0°
C22C23C24H25179.9°180.0°
C24C23C22C210.0°0.3°
C23C24C13H25180.0°179.4°
C23C24C13C200.1°0.6°
C23C24C13C12179.3°179.6°
C24C23C22H23180.0°179.7°
C8N4C7N50.5°0.0°
C8N4C7H5180.0°179.9°
C8N4C7N3178.7°180.0°
N4C8N6H41.4°0.0°
C17C18C19H31180.0°180.0°
C17C18C19C140.2°0.0°
C18C17C16H29179.9°180.0°
C17C18C19H32179.8°179.7°
C22C21C20H22180.0°180.0°
C22C21C20C130.7°0.0°
C22C21C20H21179.3°180.0°
C21C22C23H24180.0°180.0°
C15C14C19C180.5°0.1°
C15C14C19C11178.9°179.7°
C15C14C11N132.1°84.8°
C15C14C11H26152.8°155.2°
C15C14C11H2788.8°35.2°
C14C15C16H29179.7°180.0°
C15C14C19H32179.5°179.7°
N2C2C1C4115.5°119.9°
N2C2C1H14123.5°120.1°
N2C2C4H14117.8°120.0°
N2C2C1O220.4°39.3°
N2C2C4C511.9°65.8°
N2C2C1N1158.7°140.7°
N2C2C4H12107.3°174.3°
N2C2C4H13131.0°54.2°
N5C7N4N3178.2°180.0°
N5C7N3C62.1°0.0°
N5C7N4H5179.5°180.0°
N5C7N3H7177.9°180.0°
C24C13C20C210.5°0.3°
C24C13C20C12179.4°179.8°
C24C13C12N123.6°96.7°
C24C13C12H19143.7°143.3°
C24C13C12H2096.5°23.3°
C24C13C20H21179.4°179.7°
C13C24C23H24179.9°179.7°
N4C7N3C6176.1°180.0°
N4C7N5H6178.1°180.0°
N4C7N3H73.9°0.0°
C18C19C14H32180.0°179.7°
C18C19C14C11179.4°179.7°
C19C18C17H30180.0°180.0°
C7N3C6C566.8°180.0°
C7N3C6H7180.0°179.9°
N3C7N4H51.3°0.0°
N3C7N5H60.0°0.0°
C7N3C6H853.0°59.9°
C7N3C6H9173.4°60.0°
C21C20C13H21180.0°180.0°
C21C20C13C12178.9°179.9°
C20C21C22H23179.5°180.0°
C1C2C4H14120.9°120.1°
C2C1O2N1179.0°180.0°
C1C2C4C5133.1°174.2°
C2C1N1C112.2°175.3°
C2C1N1C12178.7°4.7°
C1C2C4H1213.9°54.3°
C1C2C4H13107.8°65.8°
C1C2N2H15117.8°120.0°
C4C2C1O295.1°80.6°
C2C4C5H12119.2°120.0°
C2C4C5H13119.1°120.0°
C2C4C5C6173.7°175.0°
C4C2C1N185.8°99.3°
C2C4C5H1053.1°65.0°
C2C4C5H1165.8°55.1°
C2C4H12H13122.4°120.1°
C4C2N2H151.5°120.1°
C19C14C11N1149.0°94.9°
C19C14C11H2628.3°25.1°
C19C14C11H2790.1°145.1°
C19C14C15H28179.5°180.0°
C14C19C18H31179.8°180.0°
C14C11N1C188.7°95.0°
C14C11N1H26120.8°120.0°
C14C11N1H27120.8°120.0°
C14C11N1C1292.2°85.0°
C14C11H26H27117.5°120.0°
C11C14C15H280.6°0.3°
C11C14C19H320.6°0.0°
O2C1N1C11178.8°4.8°
O2C1N1C120.3°175.3°
O2C1C2H14143.9°159.4°
C20C13C12N1155.8°83.6°
C20C13C12H1935.7°36.5°
C20C13C12H2084.1°156.4°
C13C20C21H22179.3°180.0°
C20C13C24H25179.9°180.0°
C13C12N1C149.0°95.8°
C13C12N1C11131.9°84.3°
C13C12N1H19120.1°120.0°
C13C12N1H20120.1°120.0°
C13C12H19H20119.7°120.0°
C12C13C20H211.1°0.0°
C12C13C24H250.7°0.2°
C4C5C6H10120.6°120.0°
C4C5C6H11120.5°119.9°
C4C5C6N3128.6°175.1°
C4C5C6H8111.5°55.0°
C4C5C6H98.8°65.0°
C4C5H10H11118.3°120.1°
C5C4H12H13122.4°120.0°
C5C4C2H14106.0°54.2°
C5C6N3H8119.8°120.1°
C5C6N3H9119.8°120.0°
C5C6N3H7113.2°0.1°
C5C6H8H9120.4°120.0°
C6C5H10H11118.3°120.0°
C6C5C4H1267.2°55.0°
C6C5C4H1354.5°64.9°
C1N1C11C12179.1°179.9°
N1C1C2H1435.2°20.7°
C1N1C12H1971.1°144.2°
C1N1C12H20169.1°24.2°
C1N1C11H26150.5°145.0°
C1N1C11H2732.1°25.0°
N3C6H8H9120.5°119.9°
N3C6C5H108.1°64.9°
N3C6C5H11110.8°55.1°
C11N1C12H19108.0°35.8°
C11N1C12H2011.8°155.7°
N1C11H26H27117.5°120.0°
N1C12H19H20119.7°120.0°
C12N1C11H2628.6°35.0°
C12N1C11H27146.9°155.0°
H1C9H2H3120.0°120.0°
H1C9N6H40.0°119.9°
H2C9N6H4120.0°0.1°
H3C9N6H4120.0°120.0°
H7N3C6H8127.0°120.0°
H7N3C6H96.6°120.1°
H8C6C5H10127.9°175.0°
H8C6C5H119.0°64.9°
H9C6C5H10111.8°55.0°
H9C6C5H11129.3°175.1°
H10C5C4H12172.3°175.0°
H10C5C4H1366.0°55.0°
H11C5C4H1253.4°64.9°
H11C5C4H13175.1°175.1°
H12C4C2H14134.8°65.8°
H13C4C2H1413.1°174.2°
H14C2N2H15119.0°0.1°
H21C20C21H220.7°0.0°
H22C21C22H230.5°0.0°
H23C22C23H240.1°0.0°
H24C23C24H250.1°0.3°
H28C15C16H290.3°0.0°
H29C16C17H300.1°0.0°
H30C17C18H310.0°0.0°
H31C18C19H320.2°0.3°

222926

PDB entries from 2024-07-24

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