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A1JH2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O2C21doub1.21Å1.22Å
C20N3sing1.47Å1.48Å
C20C19sing1.53Å1.53Å
C21N3sing1.35Å1.34Å
C21C22sing1.51Å1.51Å
N3C23sing1.47Å1.47Å
C19C18sing1.53Å1.52Å
C23C24sing1.53Å1.52Å
C24C18sing1.53Å1.51Å
C18N2sing1.47Å1.47Å
O1C1doub1.22Å1.22Å
N2C1sing1.35Å1.36Å
C1N1sing1.35Å1.37Å
N1C2sing1.40Å1.40Å
C17C2doub1.39Å1.38ÅAromatic
C17C16sing1.38Å1.38ÅAromatic
C2C3sing1.39Å1.38ÅAromatic
C16C5doub1.38Å1.39ÅAromatic
C3C4doub1.38Å1.38ÅAromatic
C5C4sing1.38Å1.39ÅAromatic
C5C6sing1.51Å1.52Å
C6C14sing1.53Å1.55Å
C6C7sing1.53Å1.54Å
C14C15sing1.53Å1.53Å
C14C13sing1.53Å1.53Å
C15C10sing1.53Å1.54Å
C13C12sing1.53Å1.54Å
C7C9sing1.53Å1.53Å
C7C8sing1.53Å1.53Å
C9C10sing1.53Å1.54Å
C10C11sing1.53Å1.54Å
C8C12sing1.53Å1.53Å
C12C11sing1.53Å1.53Å
N1H1sing0.97Å1.00Å
C4H2sing1.08Å1.08Å
C6H3sing1.09Å1.10Å
C7H4sing1.09Å1.10Å
C8H5sing1.09Å1.10Å
C8H6sing1.09Å1.10Å
C10H7sing1.09Å1.10Å
C13H8sing1.09Å1.10Å
C13H9sing1.09Å1.10Å
C15H10sing1.09Å1.10Å
C15H11sing1.09Å1.10Å
C17H12sing1.08Å1.08Å
C20H13sing1.09Å1.10Å
C20H14sing1.09Å1.10Å
C22H15sing1.09Å1.10Å
C22H16sing1.09Å1.10Å
C22H17sing1.09Å1.10Å
C24H18sing1.09Å1.10Å
C24H19sing1.09Å1.10Å
C3H20sing1.08Å1.08Å
C9H21sing1.09Å1.10Å
C9H22sing1.09Å1.10Å
C11H23sing1.09Å1.10Å
C11H24sing1.09Å1.10Å
C12H25sing1.09Å1.10Å
C14H26sing1.09Å1.10Å
C16H27sing1.08Å1.08Å
N2H28sing0.97Å1.00Å
C18H29sing1.09Å1.10Å
C19H30sing1.09Å1.10Å
C19H31sing1.09Å1.10Å
C23H32sing1.09Å1.10Å
C23H33sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O2C21N3120.3°120.0°
O2C21C22120.9°120.0°
N3C20C19112.5°108.8°
C20N3C21123.8°120.6°
C20N3C23116.3°118.8°
N3C20H13108.7°109.6°
N3C20H14108.7°109.6°
C20C19C18110.5°109.3°
C19C20H13108.7°109.6°
C19C20H14108.7°109.6°
C20C19H30109.2°109.5°
C20C19H31109.2°109.5°
N3C21C22118.8°120.0°
C21N3C23119.7°120.6°
C21C22H15109.5°109.5°
C21C22H16109.5°109.5°
C21C22H17109.5°109.4°
N3C23C24110.1°108.8°
N3C23H32109.3°109.6°
N3C23H33109.3°109.6°
C19C18C24108.1°109.5°
C19C18N2116.1°109.5°
C19C18H29106.4°109.4°
C18C19H30109.2°109.5°
C18C19H31109.2°109.5°
C23C24C18107.5°109.3°
C23C24H18110.0°109.5°
C23C24H19109.9°109.6°
C24C23H32109.3°109.5°
C24C23H33109.3°109.6°
C24C18N2112.1°109.5°
C18C24H18110.0°109.4°
C18C24H19110.0°109.5°
C24C18H29106.5°109.5°
C18N2C1126.8°120.0°
C18N2H28116.6°120.0°
N2C18H29107.0°109.4°
O1C1N2125.9°120.0°
O1C1N1123.3°120.0°
N2C1N1110.8°120.0°
C1N2H28116.6°120.0°
C1N1C2130.4°120.0°
C1N1H1114.8°120.0°
N1C2C17122.1°120.1°
N1C2C3118.2°120.0°
C2N1H1114.8°120.0°
C2C17C16119.9°120.0°
C17C2C3119.5°119.8°
C2C17H12120.0°120.0°
C17C16C5121.2°120.1°
C16C17H12120.0°120.0°
C17C16H27119.4°120.0°
C2C3C4120.0°119.9°
C2C3H20120.0°120.0°
C16C5C4118.0°120.1°
C16C5C6121.6°119.9°
C5C16H27119.4°119.9°
C3C4C5121.3°120.1°
C3C4H2119.3°119.9°
C4C3H20120.0°120.1°
C4C5C6120.3°120.0°
C5C4H2119.4°120.0°
C5C6C14115.5°109.5°
C5C6C7111.7°109.5°
C5C6H3107.2°109.5°
C14C6C7108.1°109.5°
C6C14C15109.8°109.5°
C6C14C13110.3°109.5°
C14C6H3106.9°109.5°
C6C14H26109.2°109.5°
C6C7C9108.4°109.5°
C6C7C8111.4°109.5°
C7C6H3106.9°109.4°
C6C7H4109.2°109.5°
C15C14C13108.9°109.4°
C14C15C10109.0°109.5°
C14C15H10109.6°109.5°
C14C15H11109.6°109.5°
C15C14H26109.3°109.4°
C14C13C12110.0°109.5°
C14C13H8109.3°109.5°
C14C13H9109.3°109.4°
C13C14H26109.3°109.5°
C15C10C9109.1°109.5°
C15C10C11110.4°109.5°
C15C10H7109.4°109.5°
C10C15H10109.6°109.4°
C10C15H11109.6°109.5°
C13C12C8109.6°109.5°
C13C12C11109.4°109.4°
C12C13H8109.3°109.5°
C12C13H9109.4°109.4°
C13C12H25109.5°109.5°
C9C7C8109.1°109.5°
C7C9C10110.1°109.5°
C9C7H4109.4°109.5°
C7C9H21109.3°109.5°
C7C9H22109.3°109.5°
C7C8C12109.4°109.5°
C8C7H4109.4°109.5°
C7C8H5109.5°109.5°
C7C8H6109.5°109.5°
C9C10C11109.0°109.5°
C9C10H7109.4°109.5°
C10C9H21109.3°109.5°
C10C9H22109.3°109.5°
C10C11C12109.0°109.5°
C11C10H7109.5°109.5°
C10C11H23109.6°109.5°
C10C11H24109.6°109.5°
C8C12C11109.4°109.5°
C12C8H5109.5°109.4°
C12C8H6109.5°109.5°
C8C12H25109.5°109.5°
C12C11H23109.6°109.5°
C12C11H24109.6°109.5°
C11C12H25109.5°109.4°
H5C8H6109.5°109.5°
H8C13H9109.5°109.5°
H10C15H11109.5°109.5°
H13C20H14109.4°109.6°
H15C22H16109.4°109.5°
H15C22H17109.5°109.5°
H16C22H17109.5°109.5°
H18C24H19109.5°109.5°
H21C9H22109.5°109.5°
H23C11H24109.5°109.5°
H30C19H31109.5°109.5°
H32C23H33109.5°109.7°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O2C21N3C2022.3°179.7°
O2C21N3C22178.8°180.0°
O2C21N3C23153.7°0.0°
O2C21C22H150.0°120.0°
O2C21C22H16120.0°0.1°
O2C21C22H17120.0°120.0°
N3C20C19H13120.5°119.8°
N3C20C19H14120.5°119.8°
C20N3C21C23176.1°179.7°
C20N3C21C22158.9°0.3°
N3C20C19C1824.8°54.6°
C20N3C23C2418.4°53.6°
N3C20H13H14118.6°120.3°
N3C20C19H30145.0°65.3°
N3C20C19H3195.3°174.6°
C20N3C23H32138.5°66.2°
C20N3C23H33101.7°173.4°
C19C20N3C21127.8°126.1°
C19C20N3C2356.0°53.6°
C20C19C18H30120.1°120.0°
C20C19C18H31120.1°120.0°
C20C19C18C2435.9°61.3°
C20C19C18N2163.0°178.6°
C19C20H13H14118.6°120.3°
C20C19C18H2978.1°58.7°
C20C19H30H31119.5°120.1°
C21N3C23C24165.2°126.1°
C21N3C20H13111.7°6.3°
C21N3C20H147.4°114.1°
N3C21C22H15178.7°60.0°
N3C21C22H1658.8°180.0°
N3C21C22H1761.2°60.0°
C21N3C23H3245.1°114.1°
C21N3C23H3374.7°6.3°
C22C21N3C2325.0°180.0°
C21C22H15H16120.0°120.0°
C21C22H15H17120.0°120.0°
C21C22H16H17120.0°119.9°
N3C23C24H32120.1°119.8°
N3C23C24H33120.1°119.8°
N3C23C24C1844.3°54.6°
C23N3C20H1364.5°173.4°
C23N3C20H14176.5°66.2°
N3C23C24H18164.1°65.3°
N3C23C24H1975.4°174.6°
N3C23H32H33119.7°120.4°
C19C18C24C2373.9°61.3°
C19C18C24N2129.3°120.0°
C19C18C24H29114.0°120.0°
C19C18N2H29118.6°119.9°
C19C18N2C1115.1°84.9°
C18C19C20H1395.6°174.4°
C18C19C20H14145.3°65.2°
C19C18C24H18166.4°58.6°
C19C18C24H1945.8°178.6°
C19C18N2H2865.0°95.1°
C18C19H30H31119.5°120.1°
C23C24C18H18119.7°119.9°
C23C24C18H19119.7°120.0°
C23C24C18N2156.8°178.6°
C23C24H18H19120.9°120.2°
C23C24C18H2940.1°58.7°
C24C23H32H33119.7°120.3°
C24C18N2H29116.4°120.0°
C24C18N2C110.0°155.0°
C18C24H18H19120.9°120.1°
C24C18N2H28170.0°25.0°
C24C18C19H3084.2°58.6°
C24C18C19H31156.1°178.7°
C18C24C23H3275.8°65.2°
C18C24C23H33164.4°174.4°
C18N2C1O126.3°0.0°
C18N2C1H28180.0°180.0°
C18N2C1N1153.5°180.0°
N2C18C24H1837.1°61.5°
N2C18C24H1983.6°58.6°
N2C18C19H3042.8°61.5°
N2C18C19H3176.9°58.6°
O1C1N2N1179.8°180.0°
O1C1N1C27.7°5.2°
O1C1N1H1172.3°175.1°
O1C1N2H28153.7°180.0°
N2C1N1C2172.1°174.8°
N2C1N1H17.9°4.9°
C1N2C18H29126.3°35.0°
C1N1C2H1180.0°179.6°
C1N1C2C1735.4°33.0°
C1N1C2C3150.2°147.2°
N1C1N2H2826.5°0.0°
N1C2C17C3174.3°179.7°
N1C2C17C16177.5°179.9°
N1C2C3C4177.4°179.7°
N1C2C17H122.5°0.3°
N1C2C3H202.6°0.3°
C2C17C16H12180.0°179.6°
C2C17C16C51.7°0.3°
C17C2C3C42.9°0.0°
C17C2N1H1144.6°146.6°
C17C2C3H20177.1°180.0°
C2C17C16H27178.3°180.0°
C16C17C2C33.2°0.3°
C17C16C5H27180.0°179.7°
C17C16C5C40.2°0.0°
C17C16C5C6179.3°179.9°
C2C3C4H20180.0°180.0°
C2C3C4C51.0°0.3°
C3C2N1H129.8°33.1°
C2C3C4H2179.0°179.9°
C3C2C17H12176.8°179.9°
C16C5C4C30.5°0.3°
C16C5C4C6179.1°180.0°
C16C5C6C1417.5°30.0°
C16C5C6C7141.6°150.0°
C16C5C4H2179.5°179.9°
C16C5C6H3101.5°90.0°
C5C16C17H12178.3°179.9°
C3C4C5H2180.0°179.7°
C3C4C5C6179.7°179.7°
C4C5C6C14161.6°150.0°
C4C5C6C737.5°30.0°
C4C5C6H379.3°89.9°
C5C4C3H20179.0°179.7°
C4C5C16H27179.8°179.7°
C5C6C14C7126.0°120.0°
C5C6C14H3119.2°120.1°
C5C6C7H3117.0°120.0°
C5C6C14C15172.4°180.0°
C5C6C14C1367.6°60.0°
C5C6C7C9170.6°180.0°
C5C6C7C869.4°60.0°
C6C5C4H20.3°0.1°
C5C6C7H451.5°60.0°
C5C6C14H2652.6°60.0°
C6C5C16H270.7°0.3°
C14C6C7H3114.8°119.9°
C6C14C15C13120.9°120.0°
C6C14C15H26119.7°120.0°
C6C14C13H26120.0°120.1°
C6C14C15C1060.8°60.0°
C6C14C13C1259.8°60.0°
C14C6C7C961.3°60.0°
C14C6C7C858.8°60.0°
C14C6C7H4179.7°180.0°
C6C14C13H860.2°180.0°
C6C14C13H9180.0°60.0°
C6C14C15H10179.3°60.0°
C6C14C15H1159.1°180.0°
C7C6C14C1561.6°60.0°
C7C6C14C1358.4°60.0°
C6C7C9C8121.4°120.0°
C6C7C9H4119.0°120.0°
C6C7C8H4120.8°120.0°
C6C7C9C1061.6°60.0°
C6C7C8C1259.7°60.0°
C6C7C8H5179.7°180.0°
C6C7C8H660.3°60.0°
C6C7C9H2158.5°60.0°
C6C7C9H22178.3°180.0°
C7C6C14H26178.5°180.0°
C15C14C13H26119.4°119.9°
C14C15C10H10120.0°120.0°
C14C15C10H11119.9°120.0°
C15C14C13C1260.7°60.1°
C14C15C10C959.5°60.0°
C14C15C10C1160.3°60.0°
C15C14C6H353.2°59.9°
C14C15C10H7179.2°180.0°
C15C14C13H8179.2°60.0°
C15C14C13H959.4°180.0°
C14C15H10H11120.2°120.0°
C13C14C15C1060.1°60.0°
C14C13C12H8120.1°120.1°
C14C13C12H9120.1°119.9°
C14C13C12C859.6°59.9°
C14C13C12C1160.3°60.1°
C13C14C6H3173.2°179.9°
C14C13H8H9119.7°120.0°
C13C14C15H1059.9°180.0°
C13C14C15H11180.0°60.0°
C14C13C12H25179.7°180.0°
C15C10C9C760.6°60.0°
C15C10C9C11120.6°120.0°
C15C10C9H7119.7°120.0°
C15C10C11H7120.5°120.0°
C15C10C11C1259.6°60.0°
C10C15H10H11120.2°119.9°
C15C10C9H2159.5°60.0°
C15C10C9H22179.3°180.0°
C15C10C11H2360.3°60.0°
C15C10C11H24179.6°180.0°
C10C15C14H26179.5°180.0°
C13C12C8C759.0°60.0°
C13C12C11C1059.0°60.0°
C13C12C8C11119.9°120.0°
C13C12C8H25120.1°120.0°
C13C12C11H25120.0°120.0°
C13C12C8H5179.0°179.9°
C13C12C8H661.0°60.0°
C12C13H8H9119.8°119.9°
C13C12C11H2360.9°60.0°
C13C12C11H24179.0°180.0°
C12C13C14H26179.9°180.0°
C9C7C8H4119.6°120.0°
C7C9C10H21120.1°120.0°
C7C9C10H22120.1°120.0°
C7C9C10C1160.0°60.0°
C9C7C8C1259.9°60.0°
C9C7C6H353.5°60.0°
C9C7C8H560.0°60.0°
C9C7C8H6179.9°180.0°
C7C9C10H7179.7°180.0°
C7C9H21H22119.7°120.0°
C8C7C9C1059.8°60.0°
C7C8C12H5120.0°120.0°
C7C8C12H6120.0°120.0°
C7C8C12C1161.0°60.0°
C8C7C6H3173.6°180.0°
C7C8H5H6120.1°120.0°
C8C7C9H21179.9°180.0°
C8C7C9H2260.3°60.0°
C7C8C12H25179.1°180.0°
C9C10C11H7119.7°120.0°
C9C10C11C1260.2°60.0°
C10C9C7H4179.4°180.0°
C9C10C15H10179.4°60.1°
C9C10C15H1160.5°180.0°
C10C9H21H22119.7°120.0°
C9C10C11H23179.8°180.0°
C9C10C11H2459.7°60.0°
C10C11C12C861.0°60.0°
C10C11C12H23119.9°120.0°
C10C11C12H24119.9°120.0°
C11C10C15H1059.6°180.0°
C11C10C15H11179.8°60.0°
C11C10C9H21179.9°180.0°
C11C10C9H2260.1°60.0°
C10C11H23H24120.2°120.0°
C10C11C12H25179.0°180.0°
C8C12C11H25120.0°120.0°
C12C8C7H4179.5°180.0°
C12C8H5H6120.0°120.0°
C8C12C13H860.5°180.0°
C8C12C13H9179.7°60.0°
C8C12C11H23179.0°180.0°
C8C12C11H2458.9°60.0°
C11C12C8H559.0°60.0°
C11C12C8H6179.0°180.0°
C12C11C10H7179.9°180.0°
C11C12C13H8179.6°60.0°
C11C12C13H959.7°180.0°
C12C11H23H24120.2°120.0°
H2C4C3H201.0°0.0°
H3C6C7H465.5°60.1°
H3C6C14H2666.7°60.0°
H4C7C8H559.5°60.0°
H4C7C8H660.5°60.0°
H4C7C9H2160.5°60.0°
H4C7C9H2259.3°60.0°
H5C8C12H2560.9°60.0°
H6C8C12H2559.0°60.0°
H7C10C15H1060.9°60.0°
H7C10C15H1159.2°60.0°
H7C10C9H2160.2°60.0°
H7C10C9H2259.6°60.0°
H7C10C11H2360.2°60.0°
H7C10C11H2459.9°59.9°
H8C13C12H2559.6°59.9°
H8C13C14H2659.8°59.9°
H9C13C12H2560.2°60.0°
H9C13C14H2660.0°60.1°
H10C15C14H2659.5°60.1°
H11C15C14H2660.6°60.0°
H12C17C16H271.7°0.4°
H13C20C19H3024.5°54.5°
H13C20C19H31144.2°65.6°
H14C20C19H3094.6°174.9°
H14C20C19H3125.2°54.8°
H15C22H16H17120.0°120.0°
H18C24C18H2979.6°178.6°
H18C24C23H3244.0°175.0°
H18C24C23H3375.9°54.6°
H19C24C18H29159.7°61.4°
H19C24C23H32164.5°54.8°
H19C24C23H3344.7°65.6°
H23C11C12H2559.1°60.0°
H24C11C12H2561.1°60.0°
H28N2C18H2953.6°145.0°
H29C18C19H30161.7°178.6°
H29C18C19H3142.0°61.3°

257179

PDB entries from 2026-07-29

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