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JZK

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1C2sing1.35Å1.40Å
C2O3doub1.22Å1.25Å
C2C4sing1.48Å1.52Å
C4C5doub1.40Å1.43ÅAromatic
C4C28sing1.39Å1.43ÅAromatic
C5C6sing1.37Å1.41ÅAromatic
C6C7doub1.39Å1.42ÅAromatic
C7N8sing1.38Å1.38ÅAromatic
C7C27sing1.41Å1.41ÅAromatic
N8C9sing1.46Å1.46Å
N8C16sing1.37Å1.37ÅAromatic
C9C10sing1.53Å1.54Å
C10C11sing1.53Å1.53Å
C10C15sing1.53Å1.55Å
C11C12sing1.53Å1.53Å
C12C13sing1.53Å1.53Å
C13C14sing1.53Å1.54Å
C14C15sing1.53Å1.54Å
C16N17sing1.38Å1.35Å
C16N26doub1.31Å1.32ÅAromatic
N17C18sing1.46Å1.44Å
C18C19sing1.51Å1.53Å
C19C20doub1.38Å1.42ÅAromatic
C19C24sing1.38Å1.43ÅAromatic
C20C21sing1.38Å1.43ÅAromatic
C21C22doub1.38Å1.43ÅAromatic
C22C23sing1.38Å1.41ÅAromatic
C23C24doub1.38Å1.42ÅAromatic
C24CL25sing1.74Å1.72Å
N26C27sing1.36Å1.35ÅAromatic
C27C28doub1.39Å1.40ÅAromatic
N1HN1sing0.97Å1.00Å
N1HN1Asing0.97Å1.00Å
C5H5sing1.08Å1.08Å
C6H6sing1.08Å1.08Å
C9H9sing1.09Å1.10Å
C9H9Asing1.09Å1.10Å
C10H10sing1.09Å1.10Å
C11H11sing1.09Å1.10Å
C11H11Asing1.09Å1.10Å
C12H12sing1.09Å1.10Å
C12H12Asing1.09Å1.10Å
C13H13sing1.09Å1.10Å
C13H13Asing1.09Å1.10Å
C14H14sing1.09Å1.10Å
C14H14Asing1.09Å1.10Å
C15H15sing1.09Å1.10Å
C15H15Asing1.09Å1.10Å
N17HN17sing0.97Å1.00Å
C18H18sing1.09Å1.10Å
C18H18Asing1.09Å1.10Å
C20H20sing1.08Å1.08Å
C21H21sing1.08Å1.08Å
C22H22sing1.08Å1.08Å
C23H23sing1.08Å1.08Å
C28H28sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N1C2O3123.5°120.0°
N1C2C4116.5°120.0°
C2N1HN1120.0°120.0°
C2N1HN1A120.0°120.0°
O3C2C4119.4°120.0°
C2C4C5119.1°119.9°
C2C4C28121.4°120.0°
C5C4C28119.4°120.1°
C4C5C6122.6°120.4°
C4C5H5118.7°119.8°
C4C28C27118.6°119.6°
C4C28H28120.7°120.2°
C5C6C7116.1°120.2°
C6C5H5118.7°119.8°
C5C6H6121.9°119.9°
C6C7N8133.8°133.7°
C6C7C27122.6°120.2°
C7C6H6121.9°119.9°
N8C7C27103.6°106.1°
C7N8C9125.4°126.3°
C7N8C16108.4°107.3°
C7C27N26110.4°107.1°
C7C27C28120.6°119.5°
C9N8C16125.3°126.4°
N8C9C10109.4°109.5°
N8C9H9109.5°109.5°
N8C9H9A109.5°109.5°
N8C16N17120.4°125.0°
N8C16N26110.5°109.9°
C9C10C11107.4°109.4°
C9C10C15110.0°109.5°
C10C9H9109.5°109.5°
C10C9H9A109.5°109.4°
C9C10H10111.8°109.4°
C11C10C15113.0°109.5°
C10C11C12113.2°109.4°
C11C10H10108.7°109.4°
C10C11H11108.3°109.5°
C10C11H11A108.2°109.4°
C10C15C14111.4°109.5°
C15C10H10106.0°109.5°
C10C15H15108.8°109.5°
C10C15H15A108.9°109.5°
C11C12C13114.2°109.5°
C12C11H11108.3°109.5°
C12C11H11A108.2°109.5°
C11C12H12107.9°109.5°
C11C12H12A108.0°109.4°
C12C13C14114.1°109.5°
C13C12H12108.0°109.5°
C13C12H12A107.9°109.5°
C12C13H13107.9°109.4°
C12C13H13A108.0°109.5°
C13C14C15107.7°109.5°
C14C13H13108.0°109.5°
C14C13H13A108.0°109.5°
C13C14H14110.1°109.5°
C13C14H14A110.1°109.5°
C15C14H14110.1°109.4°
C15C14H14A110.1°109.5°
C14C15H15108.8°109.4°
C14C15H15A108.8°109.5°
N17C16N26129.1°125.0°
C16N17C18120.0°120.0°
C16N17HN17106.1°120.0°
C16N26C27107.1°109.5°
N17C18C19116.3°109.5°
C18N17HN17106.1°120.0°
N17C18H18107.2°109.5°
N17C18H18A107.3°109.5°
C18C19C20125.0°120.0°
C18C19C24116.4°120.0°
C19C18H18107.3°109.4°
C19C18H18A107.2°109.5°
C20C19C24118.6°120.0°
C19C20C21119.0°120.0°
C19C20H20120.5°120.0°
C19C24C23122.6°119.9°
C19C24CL25117.6°120.0°
C20C21C22121.6°120.0°
C21C20H20120.5°120.0°
C20C21H21119.2°120.0°
C21C22C23119.6°120.0°
C22C21H21119.2°120.0°
C21C22H22120.2°119.9°
C22C23C24118.6°120.0°
C23C22H22120.2°120.1°
C22C23H23120.7°120.0°
C23C24CL25119.7°120.1°
C24C23H23120.7°120.0°
N26C27C28128.9°133.4°
C27C28H28120.7°120.2°
HN1N1HN1A120.0°120.0°
H9C9H9A109.5°109.5°
H11C11H11A110.7°109.5°
H12C12H12A110.9°109.5°
H13C13H13A111.0°109.5°
H14C14H14A108.8°109.5°
H15C15H15A110.1°109.5°
H18C18H18A111.6°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N1C2O3C4170.8°180.0°
N1C2C4C5176.1°0.0°
N1C2C4C287.7°179.7°
C2N1HN1HN1A180.0°179.8°
O3C2C4C512.4°180.0°
O3C2C4C28163.8°0.3°
O3C2N1HN10.0°0.1°
O3C2N1HN1A180.0°179.8°
C2C4C5C28176.3°179.7°
C2C4C5C6175.7°180.0°
C2C4C28C27176.3°179.7°
C4C2N1HN1171.1°180.0°
C4C2N1HN1A8.9°0.2°
C2C4C5H54.3°0.0°
C2C4C28H283.7°0.0°
C4C5C6H5180.0°179.9°
C4C5C6C71.0°0.0°
C5C4C28C270.1°0.6°
C4C5C6H6179.0°179.9°
C5C4C28H28179.9°179.7°
C28C4C5C60.5°0.3°
C4C28C27C70.2°0.5°
C4C28C27N26178.8°179.8°
C4C28C27H28180.0°179.8°
C28C4C5H5179.5°179.8°
C5C6C7H6180.0°179.9°
C5C6C7N8179.7°180.0°
C5C6C7C271.0°0.0°
C6C7N8C27178.9°180.0°
C6C7N8C910.9°0.0°
C6C7N8C16179.3°180.0°
C6C7C27N26179.5°180.0°
C6C7C27C280.4°0.3°
C7C6C5H5179.0°180.0°
C7N8C9C16168.1°179.9°
C7N8C9C1093.1°90.0°
C7N8C16N17179.4°180.0°
C7N8C16N261.6°0.0°
N8C7C27N261.5°0.0°
N8C7C27C28179.4°179.7°
N8C7C6H60.3°0.0°
C7N8C9H9146.9°150.0°
C7N8C9H9A26.9°30.0°
C27C7N8C9168.0°180.0°
C27C7N8C161.8°0.0°
C7C27N26C160.5°0.0°
C7C27N26C28179.0°179.7°
C27C7C6H6179.0°179.9°
C7C27C28H28179.8°179.7°
N8C9C10H9120.0°120.0°
N8C9C10H9A120.0°120.0°
N8C9C10C11160.3°175.0°
N8C9C10C1576.4°65.0°
C9N8C16N1710.8°0.1°
C9N8C16N26168.2°180.0°
N8C9H9H9A120.0°120.0°
N8C9C10H1041.1°55.1°
C16N8C9C1075.0°90.0°
N8C16N17N26178.8°179.9°
N8C16N17C18165.9°180.0°
N8C16N26C270.7°0.0°
C16N8C9H944.9°30.1°
C16N8C9H9A165.0°150.1°
N8C16N17HN1745.9°0.1°
C9C10C11C15121.4°120.0°
C9C10C11H10121.1°119.9°
C9C10C15H10121.0°120.0°
C9C10C11C1293.4°180.0°
C9C10C15C14150.3°180.0°
C10C9H9H9A120.0°120.0°
C9C10C11H11146.6°60.0°
C9C10C11H11A26.6°60.0°
C9C10C15H1530.3°60.0°
C9C10C15H15A89.7°60.0°
C11C10C15H10119.0°120.0°
C10C11C12H11120.0°120.0°
C10C11C12H11A120.0°120.0°
C10C11C12C1353.0°60.0°
C11C10C15C1430.4°60.0°
C11C10C9H940.3°54.9°
C11C10C9H9A79.7°65.0°
C10C11H11H11A118.5°120.0°
C10C11C12H12173.0°60.0°
C10C11C12H12A67.0°180.0°
C11C10C15H1589.6°60.0°
C11C10C15H15A150.4°180.0°
C15C10C11C1228.1°60.0°
C10C15C14C1366.3°60.0°
C10C15C14H15120.0°120.0°
C10C15C14H15A120.0°120.0°
C15C10C9H9163.6°175.0°
C15C10C9H9A43.6°55.0°
C15C10C11H1191.9°180.0°
C15C10C11H11A148.1°60.0°
C10C15C14H1453.7°60.0°
C10C15C14H14A173.7°180.0°
C10C15H15H15A119.3°120.0°
C11C12C13H12120.0°120.0°
C11C12C13H12A120.0°120.0°
C11C12C13C1415.8°60.0°
C12C11C10H10145.5°60.1°
C12C11H11H11A118.5°120.0°
C11C12H12H12A118.1°120.0°
C11C12C13H13104.2°180.0°
C11C12C13H13A135.8°60.0°
C12C13C14H13120.0°120.0°
C12C13C14H13A120.0°120.0°
C12C13C14C1541.5°60.0°
C13C12C11H1167.0°180.0°
C13C12C11H11A173.0°60.0°
C13C12H12H12A118.1°120.1°
C12C13H13H13A118.1°120.0°
C12C13C14H1478.5°60.0°
C12C13C14H14A161.5°180.0°
C13C14C15H14120.0°120.0°
C13C14C15H14A120.0°120.0°
C14C13C12H12135.8°60.0°
C14C13C12H12A104.2°180.0°
C14C13H13H13A118.1°120.0°
C13C14H14H14A120.7°120.0°
C13C14C15H1553.7°60.0°
C13C14C15H15A173.6°180.0°
C14C15C10H1088.6°60.0°
C15C14C13H13161.5°179.9°
C15C14C13H13A78.5°60.0°
C15C14H14H14A120.8°120.0°
C14C15H15H15A119.2°120.0°
C16N17C18HN17120.0°179.9°
C16N17C18C1976.8°180.0°
N17C16N26C27179.5°180.0°
C16N17C18H18163.2°60.0°
C16N17C18H18A43.2°60.0°
N26C16N17C1815.3°0.1°
C16N26C27C28179.5°179.7°
N26C16N17HN17135.3°179.9°
N17C18C19H18120.0°120.0°
N17C18C19H18A120.0°120.0°
N17C18C19C2023.3°105.0°
N17C18C19C24157.5°75.2°
N17C18H18H18A117.2°120.0°
C18C19C20C24179.3°179.8°
C18C19C20C21179.0°180.0°
C18C19C24C23179.0°179.7°
C18C19C24CL251.1°0.1°
C19C18N17HN1743.2°0.1°
C19C18H18H18A117.2°120.0°
C18C19C20H201.0°0.0°
C19C20C21H20180.0°180.0°
C19C20C21C220.1°0.0°
C20C19C24C230.3°0.6°
C20C19C24CL25179.6°179.7°
C20C19C18H1896.7°15.0°
C20C19C18H18A143.3°135.0°
C19C20C21H21179.9°180.0°
C24C19C20C210.2°0.3°
C19C24C23C220.3°0.6°
C19C24C23CL25179.9°179.7°
C24C19C18H1882.6°164.7°
C24C19C18H18A37.4°44.8°
C24C19C20H20179.7°179.7°
C19C24C23H23179.7°179.7°
C20C21C22H21180.0°180.0°
C20C21C22C230.0°0.0°
C20C21C22H22180.0°180.0°
C21C22C23H22180.0°180.0°
C21C22C23C240.1°0.3°
C22C21C20H20179.9°180.0°
C21C22C23H23179.9°180.0°
C22C23C24H23180.0°179.7°
C22C23C24CL25179.7°179.7°
C23C22C21H21180.0°180.0°
C24C23C22H22179.9°179.7°
CL25C24C23H230.4°0.0°
N26C27C28H281.2°0.0°
H5C5C6H61.0°0.0°
H9C9C10H1078.9°65.0°
H9AC9C10H10161.1°175.1°
H10C10C11H1125.5°59.9°
H10C10C11H11A94.5°179.9°
H10C10C15H15151.4°180.0°
H10C10C15H15A31.4°60.0°
H11C11C12H1253.0°60.0°
H11C11C12H12A173.0°60.0°
H11AC11C12H1267.0°180.0°
H11AC11C12H12A53.0°60.0°
H12C12C13H1315.8°60.0°
H12C12C13H13A104.2°180.0°
H12AC12C13H13135.8°60.0°
H12AC12C13H13A15.8°60.0°
H13C13C14H1441.4°60.0°
H13C13C14H14A78.5°60.0°
H13AC13C14H14161.5°180.0°
H13AC13C14H14A41.5°60.0°
H14C14C15H15173.7°NaN°
H14C14C15H15A66.3°60.0°
H14AC14C15H1566.4°60.0°
H14AC14C15H15A53.6°60.0°
HN17N17C18H1876.8°119.9°
HN17N17C18H18A163.2°120.1°
H20C20C21H210.1°0.0°
H21C21C22H220.0°0.0°
H22C22C23H230.1°0.0°

223532

PDB entries from 2024-08-07

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