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A1JK3

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C7C8sing1.53Å1.52Å
C8C9sing1.53Å1.52Å
C26N10sing1.35Å1.34ÅAromatic
C26C13doub1.35Å1.36ÅAromatic
C9N10sing1.46Å1.46Å
C14C13sing1.51Å1.50Å
C14C15sing1.53Å1.52Å
N10N11sing1.29Å1.34ÅAromatic
C13N12sing1.34Å1.36ÅAromatic
C15C16sing1.53Å1.52Å
C16C17sing1.53Å1.52Å
N11N12doub1.29Å1.31ÅAromatic
C17C18sing1.53Å1.52Å
C25C24sing1.53Å1.52Å
C18C19sing1.53Å1.52Å
C19C20sing1.53Å1.52Å
C20C21sing1.53Å1.52Å
C21C22sing1.53Å1.52Å
C24C23sing1.53Å1.52Å
C22C23sing1.53Å1.53Å
C7H1sing1.09Å1.10Å
C7H2sing1.09Å1.10Å
C7H3sing1.09Å1.10Å
C8H4sing1.09Å1.10Å
C8H5sing1.09Å1.10Å
C14H6sing1.09Å1.10Å
C14H7sing1.09Å1.10Å
C15H8sing1.09Å1.10Å
C15H9sing1.09Å1.10Å
C16H10sing1.09Å1.10Å
C16H11sing1.09Å1.10Å
C17H12sing1.09Å1.10Å
C17H13sing1.09Å1.10Å
C18H14sing1.09Å1.10Å
C18H15sing1.09Å1.10Å
C19H16sing1.09Å1.10Å
C19H17sing1.09Å1.10Å
C20H18sing1.09Å1.10Å
C20H19sing1.09Å1.10Å
C21H20sing1.09Å1.10Å
C21H21sing1.09Å1.10Å
C22H22sing1.09Å1.10Å
C22H23sing1.09Å1.10Å
C23H24sing1.09Å1.10Å
C23H25sing1.09Å1.10Å
C24H26sing1.09Å1.10Å
C24H27sing1.09Å1.10Å
C25H28sing1.09Å1.10Å
C25H29sing1.09Å1.10Å
C25H30sing1.09Å1.10Å
C26H31sing1.08Å1.08Å
C9H32sing1.09Å1.10Å
C9H33sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C7C8C9111.8°109.5°
C8C7H1109.5°109.5°
C8C7H2109.4°109.5°
C8C7H3109.5°109.5°
C7C8H4108.9°109.5°
C7C8H5108.9°109.5°
C8C9N10112.7°109.5°
C9C8H4108.9°109.5°
C9C8H5108.9°109.4°
C8C9H32108.6°109.5°
C8C9H33108.7°109.4°
N10C26C13105.2°106.2°
C26N10C9128.6°125.9°
C26N10N11110.7°108.2°
N10C26H31127.4°126.9°
C26C13C14130.3°126.8°
C26C13N12107.9°106.5°
C13C26H31127.4°126.9°
C9N10N11120.7°125.9°
N10C9H32108.7°109.5°
N10C9H33108.7°109.5°
C13C14C15113.1°109.5°
C14C13N12121.8°126.7°
C13C14H6108.6°109.4°
C13C14H7108.6°109.4°
C14C15C16112.4°109.4°
C15C14H6108.6°109.5°
C15C14H7108.5°109.5°
C14C15H8108.7°109.5°
C14C15H9108.7°109.5°
N10N11N12106.9°110.2°
C13N12N11109.2°108.8°
C15C16C17113.3°109.4°
C16C15H8108.8°109.4°
C16C15H9108.7°109.5°
C15C16H10108.5°109.5°
C15C16H11108.5°109.5°
C16C17C18113.9°109.5°
C17C16H10108.5°109.5°
C17C16H11108.5°109.5°
C16C17H12108.4°109.5°
C16C17H13108.4°109.5°
C17C18C19114.2°109.5°
C18C17H12108.4°109.4°
C18C17H13108.3°109.5°
C17C18H14108.2°109.4°
C17C18H15108.3°109.4°
C25C24C23113.6°109.5°
C25C24H26108.5°109.4°
C25C24H27108.4°109.4°
C24C25H28109.5°109.4°
C24C25H29109.4°109.5°
C24C25H30109.5°109.5°
C18C19C20113.9°109.5°
C19C18H14108.3°109.5°
C19C18H15108.3°109.5°
C18C19H16108.3°109.5°
C18C19H17108.4°109.5°
C19C20C21114.7°109.5°
C20C19H16108.4°109.4°
C20C19H17108.4°109.5°
C19C20H18108.2°109.4°
C19C20H19108.1°109.4°
C20C21C22115.0°109.5°
C21C20H18108.1°109.5°
C21C20H19108.2°109.5°
C20C21H20108.1°109.5°
C20C21H21108.1°109.5°
C21C22C23115.1°109.5°
C22C21H20108.1°109.4°
C22C21H21108.1°109.5°
C21C22H22108.1°109.5°
C21C22H23108.1°109.5°
C24C23C22115.1°109.5°
C24C23H24108.1°109.4°
C24C23H25108.0°109.5°
C23C24H26108.4°109.5°
C23C24H27108.4°109.5°
C23C22H22108.1°109.5°
C23C22H23108.1°109.4°
C22C23H24108.1°109.5°
C22C23H25108.1°109.5°
H1C7H2109.5°109.4°
H1C7H3109.5°109.5°
H2C7H3109.4°109.5°
H4C8H5109.5°109.5°
H6C14H7109.4°109.5°
H8C15H9109.5°109.5°
H10C16H11109.5°109.5°
H12C17H13109.4°109.4°
H14C18H15109.5°109.5°
H16C19H17109.5°109.4°
H18C20H19109.5°109.5°
H20C21H21109.4°109.5°
H22C22H23109.4°109.5°
H24C23H25109.5°109.5°
H26C24H27109.5°109.5°
H28C25H29109.5°109.5°
H28C25H30109.5°109.5°
H29C25H30109.5°109.5°
H32C9H33109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C7C8C9H4120.3°120.0°
C7C8C9H5120.4°120.0°
C7C8C9N10176.4°180.0°
C8C7H1H2120.0°120.0°
C8C7H1H3120.0°120.0°
C8C7H2H3120.0°120.0°
C7C8H4H5119.0°120.0°
C7C8C9H3255.9°60.0°
C7C8C9H3363.1°60.0°
C8C9N10C2635.8°125.0°
C8C9N10H32120.5°120.0°
C8C9N10H33120.5°120.0°
C8C9N10N11145.0°55.0°
C9C8C7H1180.0°180.0°
C9C8C7H260.0°60.0°
C9C8C7H360.0°60.0°
C9C8H4H5118.9°120.0°
C8C9H32H33118.5°120.0°
N10C26C13H31180.0°179.9°
C26N10C9N11179.2°180.0°
N10C26C13C14179.8°179.8°
N10C26C13N120.0°0.0°
C26N10N11N120.1°0.0°
C26N10C9H3284.7°5.0°
C26N10C9H33156.2°115.0°
C13C26N10C9179.4°180.0°
C26C13C14N12179.8°179.7°
C26C13C14C1551.1°125.3°
C13C26N10N110.1°0.0°
C26C13N12N110.0°0.0°
C26C13C14H6171.6°114.7°
C26C13C14H769.5°5.3°
C9N10N11N12179.4°180.0°
N10C9C8H463.2°60.0°
N10C9C8H556.1°60.0°
C9N10C26H310.6°0.1°
N10C9H32H33118.5°120.0°
C13C14C15H6120.6°120.0°
C13C14C15H7120.6°120.0°
C13C14C15C16172.6°180.0°
C14C13N12N11179.8°179.8°
C13C14H6H7118.3°119.9°
C13C14C15H866.9°60.0°
C13C14C15H952.2°60.0°
C14C13C26H310.2°0.3°
C15C14C13N12128.7°55.0°
C14C15C16H8120.4°120.0°
C14C15C16H9120.4°120.1°
C14C15C16C1755.9°180.0°
C15C14H6H7118.3°120.1°
C14C15H8H9118.6°120.1°
C14C15C16H1064.7°60.0°
C14C15C16H11176.5°60.0°
N10N11N12C130.1°0.0°
N11N10C26H31179.9°179.9°
N11N10C9H3294.5°175.0°
N11N10C9H3324.5°65.0°
N12C13C14H68.1°65.0°
N12C13C14H7110.8°175.0°
N12C13C26H31179.9°179.9°
C15C16C17H10120.6°120.0°
C15C16C17H11120.6°120.0°
C15C16C17C18176.0°180.0°
C16C15C14H652.0°60.1°
C16C15C14H766.8°60.0°
C16C15H8H9118.6°120.0°
C15C16H10H11118.2°120.0°
C15C16C17H1255.3°60.0°
C15C16C17H1363.4°60.0°
C16C17C18H12120.7°120.0°
C16C17C18H13120.7°120.0°
C16C17C18C19159.5°180.0°
C17C16C15H8176.3°60.0°
C17C16C15H964.6°60.0°
C17C16H10H11118.2°120.0°
C16C17H12H13118.0°120.0°
C16C17C18H1438.9°60.0°
C16C17C18H1579.7°60.0°
C17C18C19H14120.7°120.0°
C17C18C19H15120.7°120.0°
C17C18C19C20177.7°180.0°
C18C17C16H1063.4°60.0°
C18C17C16H1155.4°60.0°
C18C17H12H13117.9°119.9°
C17C18H14H15117.8°120.0°
C17C18C19H1661.7°60.0°
C17C18C19H1757.0°60.0°
C25C24C23H26120.7°120.0°
C25C24C23H27120.6°120.0°
C25C24C23C22103.6°NaN°
C25C24C23H24135.6°60.0°
C25C24C23H2517.2°60.0°
C25C24H26H27118.1°119.9°
C24C25H28H29120.0°120.0°
C24C25H28H30120.0°119.9°
C24C25H29H30120.0°120.0°
C18C19C20H16120.6°120.0°
C18C19C20H17120.7°120.0°
C18C19C20C21160.5°180.0°
C19C18C17H1279.8°60.0°
C19C18C17H1338.9°60.0°
C19C18H14H15117.8°120.0°
C18C19H16H17118.0°120.0°
C18C19C20H1839.8°60.0°
C18C19C20H1978.7°60.0°
C19C20C21H18120.8°119.9°
C19C20C21H19120.7°120.0°
C19C20C21C2261.8°180.0°
C20C19C18H1457.0°60.0°
C20C19C18H1561.6°60.0°
C20C19H16H17118.0°120.0°
C19C20H18H19117.6°120.0°
C19C20C21H2059.0°60.1°
C19C20C21H21177.4°60.0°
C20C21C22H20120.8°120.0°
C20C21C22H21120.8°120.1°
C20C21C22C23178.6°180.0°
C21C20C19H1678.8°60.0°
C21C20C19H1739.9°59.9°
C21C20H18H19117.6°120.1°
C20C21H20H21117.5°120.1°
C20C21C22H2260.6°60.0°
C20C21C22H2357.8°60.0°
C21C22C23C2466.8°180.0°
C21C22C23H22120.8°120.0°
C21C22C23H23120.8°120.0°
C22C21C20H18177.4°60.1°
C22C21C20H1958.9°60.0°
C22C21H20H21117.5°120.0°
C21C22H22H23117.4°120.1°
C21C22C23H24172.4°60.0°
C21C22C23H2554.0°60.0°
C24C23C22H24120.8°120.0°
C24C23C22H25120.8°120.0°
C24C23C22H22172.4°60.0°
C24C23C22H2354.0°60.0°
C24C23H24H25117.4°120.0°
C23C24H26H27118.1°120.1°
C23C24C25H28180.0°60.0°
C23C24C25H2960.0°180.0°
C23C24C25H3060.0°60.0°
C23C22C21H2057.8°60.0°
C23C22C21H2160.6°60.0°
C23C22H22H23117.4°119.9°
C22C23H24H25117.5°120.0°
C22C23C24H2617.0°60.0°
C22C23C24H27135.8°60.0°
H1C7H2H3120.0°120.0°
H1C7C8H459.7°60.0°
H1C7C8H559.7°60.0°
H2C7C8H460.3°60.0°
H2C7C8H5179.7°180.0°
H3C7C8H4179.7°180.0°
H3C7C8H560.4°60.0°
H4C8C9H32176.3°180.0°
H4C8C9H3357.3°60.0°
H5C8C9H3264.4°60.0°
H5C8C9H33176.6°180.0°
H6C14C15H8172.5°180.0°
H6C14C15H968.4°60.0°
H7C14C15H853.6°60.0°
H7C14C15H9172.7°180.0°
H8C15C16H1055.7°180.0°
H8C15C16H1163.1°60.0°
H9C15C16H10174.8°60.0°
H9C15C16H1156.0°180.0°
H10C16C17H12175.9°180.0°
H10C16C17H1357.2°60.0°
H11C16C17H1265.3°60.0°
H11C16C17H13176.0°180.0°
H12C17C18H14159.5°180.0°
H12C17C18H1540.9°60.0°
H13C17C18H1481.8°60.0°
H13C17C18H15159.6°180.0°
H14C18C19H16177.6°180.0°
H14C18C19H1763.7°60.0°
H15C18C19H1659.0°60.0°
H15C18C19H17177.7°180.0°
H16C19C20H18160.4°180.0°
H16C19C20H1941.9°60.0°
H17C19C20H1880.9°60.0°
H17C19C20H19160.6°180.0°
H18C20C21H2061.8°NaN°
H18C20C21H2156.6°60.0°
H19C20C21H20179.8°59.9°
H19C20C21H2161.9°180.0°
H20C21C22H22178.6°180.0°
H20C21C22H2363.1°60.0°
H21C21C22H2260.2°60.0°
H21C21C22H23178.6°179.9°
H22C22C23H2451.5°179.9°
H22C22C23H2566.8°60.0°
H23C22C23H2466.8°60.0°
H23C22C23H25174.8°180.0°
H24C23C24H26103.8°180.0°
H24C23C24H2715.0°60.0°
H25C23C24H26137.8°60.0°
H25C23C24H27103.4°180.0°
H26C24C25H2859.4°60.0°
H26C24C25H2960.6°60.0°
H26C24C25H30179.4°180.0°
H27C24C25H2859.4°180.0°
H27C24C25H29179.4°60.0°
H27C24C25H3060.6°60.1°
H28C25H29H30120.0°120.0°

248942

PDB entries from 2026-02-11

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