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YHY

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C14C15doub1.38Å1.38ÅAromatic
C14C13sing1.38Å1.38ÅAromatic
C15C10sing1.39Å1.40ÅAromatic
C8C9sing1.53Å1.53Å
C8N7sing1.47Å1.48Å
C13C12doub1.39Å1.39ÅAromatic
C9C4sing1.53Å1.53Å
C10N7sing1.40Å1.43Å
C10C11doub1.39Å1.42ÅAromatic
N7C6sing1.47Å1.48Å
C12C11sing1.39Å1.39ÅAromatic
C12N16sing1.40Å1.40Å
C1N2sing1.47Å1.49Å
C4N2sing1.47Å1.50Å
C4C5sing1.53Å1.53Å
O18C17doub1.22Å1.24Å
N16C17sing1.35Å1.35Å
N2C3sing1.47Å1.49Å
C6C5sing1.53Å1.53Å
C17C19sing1.47Å1.46Å
C19N29sing1.38Å1.38ÅAromatic
C19C20doub1.36Å1.36ÅAromatic
N29C22sing1.38Å1.36ÅAromatic
C20C21sing1.41Å1.41ÅAromatic
C22C21doub1.41Å1.41ÅAromatic
C22C23sing1.39Å1.39ÅAromatic
C24C23sing1.51Å1.52Å
C21C27sing1.40Å1.39ÅAromatic
C23C25doub1.38Å1.37ÅAromatic
C27F28sing1.35Å1.37Å
C27C26doub1.38Å1.38ÅAromatic
C25C26sing1.39Å1.41ÅAromatic
C1H1sing1.09Å1.10Å
C1H2sing1.09Å1.10Å
C1H3sing1.09Å1.10Å
C3H5sing1.09Å1.10Å
C3H6sing1.09Å1.10Å
C3H7sing1.09Å1.10Å
C4H8sing1.09Å1.10Å
C5H9sing1.09Å1.10Å
C5H10sing1.09Å1.10Å
C6H11sing1.09Å1.10Å
C6H12sing1.09Å1.10Å
C8H13sing1.09Å1.10Å
C8H14sing1.09Å1.10Å
C9H15sing1.09Å1.10Å
C9H16sing1.09Å1.10Å
C11H17sing1.08Å1.08Å
C13H18sing1.08Å1.08Å
C14H19sing1.08Å1.08Å
C15H20sing1.08Å1.08Å
N16H21sing0.97Å1.00Å
C20H22sing1.08Å1.08Å
C24H23sing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C24H25sing1.09Å1.10Å
C25H26sing1.08Å1.08Å
C26H27sing1.08Å1.08Å
N29H28sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C15C14C13121.8°120.1°
C14C15C10120.9°120.1°
C15C14H19119.1°119.9°
C14C15H20119.6°120.0°
C14C13C12119.5°120.1°
C14C13H18120.3°120.0°
C13C14H19119.1°119.9°
C15C10N7123.3°120.1°
C15C10C11116.3°119.9°
C10C15H20119.5°119.9°
C9C8N7110.3°109.5°
C8C9C4111.2°109.3°
C9C8H13109.3°109.4°
C9C8H14109.3°109.4°
C8C9H15109.0°109.5°
C8C9H16109.1°109.5°
C8N7C10117.6°111.0°
C8N7C6113.7°111.2°
N7C8H13109.3°109.5°
N7C8H14109.3°109.5°
C13C12C11118.9°119.9°
C13C12N16124.2°120.0°
C12C13H18120.3°120.0°
C9C4N2110.7°109.5°
C9C4C5106.6°109.2°
C9C4H8109.3°109.5°
C4C9H15109.0°109.5°
C4C9H16109.0°109.5°
N7C10C11120.5°120.0°
C10N7C6114.6°111.0°
C10C11C12122.6°119.8°
C10C11H17118.7°120.1°
N7C6C5117.6°109.5°
N7C6H11107.4°109.4°
N7C6H12107.4°109.5°
C11C12N16116.8°120.0°
C12C11H17118.7°120.1°
C12N16C17124.1°120.0°
C12N16H21117.9°120.0°
C1N2C4113.9°111.0°
C1N2C3109.7°111.0°
N2C1H1109.5°109.4°
N2C1H2109.5°109.4°
N2C1H3109.5°109.4°
N2C4C5111.2°109.5°
C4N2C3113.9°111.0°
N2C4H8109.7°109.5°
C4C5C6112.8°109.3°
C5C4H8109.3°109.6°
C4C5H9108.7°109.5°
C4C5H10108.6°109.5°
O18C17N16122.7°120.0°
O18C17C19118.3°120.0°
N16C17C19119.0°120.0°
C17N16H21117.9°120.0°
N2C3H5109.5°109.5°
N2C3H6109.5°109.5°
N2C3H7109.5°109.4°
C6C5H9108.6°109.5°
C6C5H10108.7°109.6°
C5C6H11107.4°109.4°
C5C6H12107.4°109.5°
C17C19N29121.1°125.4°
C17C19C20129.5°125.4°
N29C19C20109.4°109.1°
C19N29C22108.9°108.8°
C19N29H28125.5°125.6°
C19C20C21107.2°107.7°
C19C20H22126.4°126.1°
N29C22C21107.5°107.3°
N29C22C23131.1°133.1°
C22N29H28125.6°125.6°
C20C21C22107.0°107.0°
C20C21C27133.9°133.4°
C21C20H22126.4°126.1°
C21C22C23121.4°119.6°
C22C21C27119.1°119.6°
C22C23C24118.1°120.0°
C22C23C25119.4°120.0°
C24C23C25122.5°120.0°
C23C24H23109.5°109.4°
C23C24H24109.5°109.5°
C23C24H25109.5°109.5°
C21C27F28119.8°120.1°
C21C27C26118.8°119.7°
C23C25C26119.5°120.7°
C23C25H26120.2°119.7°
F28C27C26121.4°120.2°
C27C26C25121.9°120.5°
C27C26H27119.0°119.8°
C26C25H26120.2°119.6°
C25C26H27119.1°119.8°
H1C1H2109.5°109.5°
H1C1H3109.4°109.5°
H2C1H3109.5°109.5°
H5C3H6109.5°109.5°
H5C3H7109.5°109.5°
H6C3H7109.4°109.4°
H9C5H10109.4°109.5°
H11C6H12109.5°109.5°
H13C8H14109.5°109.5°
H15C9H16109.5°109.5°
H23C24H24109.4°109.5°
H23C24H25109.5°109.5°
H24C24H25109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C15C14C13H19180.0°179.4°
C14C15C10H20180.0°179.5°
C15C14C13C121.9°0.3°
C14C15C10N7179.1°179.7°
C14C15C10C110.7°0.6°
C15C14C13H18178.1°179.7°
C13C14C15C100.9°0.6°
C14C13C12H18180.0°179.9°
C14C13C12C111.1°0.1°
C14C13C12N16179.5°179.9°
C13C14C15H20179.1°180.0°
C15C10N7C88.8°0.3°
C15C10N7C11179.8°179.7°
C15C10N7C6146.4°123.9°
C15C10C11C121.5°0.3°
C15C10C11H17178.5°179.8°
C10C15C14H19179.0°180.0°
C9C8N7H13120.2°120.0°
C9C8N7H14120.1°120.0°
C8C9C4H15120.2°119.9°
C8C9C4H16120.3°120.0°
C9C8N7C10172.7°174.1°
C9C8N7C649.4°61.7°
C8C9C4N2176.3°177.6°
C8C9C4C562.7°57.7°
C8C9C4H855.3°62.3°
C9C8H13H14119.6°120.0°
C8C9H15H16119.2°120.1°
N7C8C9C462.6°59.2°
C8N7C10C6137.6°124.2°
C8N7C10C11171.4°180.0°
C8N7C6C541.2°61.7°
C8N7C6H1179.9°178.3°
C8N7C6H12162.4°58.3°
N7C8H13H14119.6°120.0°
N7C8C9H1557.6°179.1°
N7C8C9H16177.1°60.8°
C13C12C11C100.6°0.1°
C13C12C11N16178.5°180.0°
C13C12N16C1735.9°144.9°
C13C12C11H17179.4°179.9°
C12C13C14H19178.1°179.7°
C13C12N16H21144.1°35.1°
C9C4N2C170.4°60.3°
C9C4N2C5118.3°119.7°
C9C4N2H8120.7°120.1°
C9C4C5H8118.0°120.0°
C9C4N2C3162.8°175.7°
C9C4C5C651.5°57.7°
C9C4C5H969.0°62.3°
C9C4C5H10172.0°177.7°
C4C9C8H1357.5°179.2°
C4C9C8H14177.3°60.8°
C4C9H15H16119.2°120.1°
N7C10C11C12178.3°180.0°
C10N7C6C5179.5°174.2°
C10N7C6H1159.3°54.2°
C10N7C6H1258.3°65.8°
C10N7C8H1367.2°54.1°
C10N7C8H1452.6°65.9°
N7C10C11H171.7°0.1°
N7C10C15H200.9°0.3°
C11C10N7C633.8°55.7°
C10C11C12H17180.0°179.9°
C10C11C12N16177.9°179.9°
C11C10C15H20179.3°180.0°
N7C6C5C443.0°59.2°
N7C6C5H11121.2°120.0°
N7C6C5H12121.2°120.0°
N7C6C5H977.5°60.8°
N7C6C5H10163.5°179.1°
N7C6H11H12116.3°120.0°
C6N7C8H1370.8°178.3°
C6N7C8H14169.5°58.2°
C11C12N16C17145.7°35.1°
C11C12C13H18178.9°180.0°
C11C12N16H2134.3°144.9°
C12N16C17O180.7°4.6°
C12N16C17H21180.0°180.0°
C12N16C17C19179.9°175.4°
N16C12C11H172.1°0.1°
N16C12C13H180.5°0.0°
C1N2C4C3126.7°124.0°
C1N2C4C5171.2°180.0°
N2C1H1H2120.0°119.9°
N2C1H1H3120.0°120.0°
N2C1H2H3120.0°120.0°
C1N2C3H5180.0°63.9°
C1N2C3H660.0°176.0°
C1N2C3H760.0°56.1°
C1N2C4H850.2°59.8°
N2C4C5H8121.2°120.1°
N2C4C5C6172.3°177.5°
C4N2C1H1180.0°176.1°
C4N2C1H260.0°56.1°
C4N2C1H360.0°63.9°
C4N2C3H551.1°60.0°
C4N2C3H6171.1°60.0°
C4N2C3H768.9°180.0°
N2C4C5H951.8°57.6°
N2C4C5H1067.2°62.5°
N2C4C9H1563.5°62.5°
N2C4C9H1656.0°57.6°
C5C4N2C344.5°56.0°
C4C5C6H9120.5°119.9°
C4C5C6H10120.5°120.0°
C4C5H9H10118.5°120.1°
C4C5C6H1178.1°179.2°
C4C5C6H12164.2°60.9°
C5C4C9H1557.5°177.6°
C5C4C9H16177.0°62.3°
O18C17N16C19179.5°180.0°
O18C17C19N2911.5°180.0°
O18C17C19C20166.9°0.3°
O18C17N16H21179.3°175.4°
N16C17C19N29168.0°0.0°
N16C17C19C2013.6°179.7°
C3N2C1H151.1°60.0°
C3N2C1H2171.1°180.0°
C3N2C1H368.9°60.0°
N2C3H5H6120.0°120.1°
N2C3H5H7120.0°120.0°
N2C3H6H7120.0°119.9°
C3N2C4H876.5°64.2°
C6C5C4H866.5°62.3°
C6C5H9H10118.5°120.1°
C5C6H11H12116.3°120.0°
C17C19N29C20178.7°179.7°
C17C19N29C22179.9°179.8°
C17C19C20C21179.4°180.0°
C19C17N16H210.1°4.6°
C17C19C20H220.6°0.1°
C17C19N29H280.1°0.1°
C19N29C22H28180.0°179.8°
N29C19C20C210.9°0.3°
C19N29C22C211.4°0.5°
C19N29C22C23180.0°179.8°
N29C19C20H22179.1°179.8°
C20C19N29C221.5°0.5°
C19C20C21H22180.0°180.0°
C19C20C21C220.1°0.0°
C19C20C21C27179.1°180.0°
C20C19N29H28178.5°179.8°
N29C22C21C200.8°0.3°
N29C22C21C23178.8°179.8°
N29C22C23C241.9°0.3°
N29C22C21C27179.8°179.7°
N29C22C23C25179.7°179.6°
C20C21C22C27179.3°180.0°
C20C21C22C23179.6°180.0°
C20C21C27F280.6°0.0°
C20C21C27C26179.9°180.0°
C21C22C23C24179.7°180.0°
C21C22C23C251.2°0.0°
C22C21C27F28179.7°180.0°
C22C21C27C260.7°0.0°
C22C21C20H22179.9°180.0°
C21C22N29H28178.6°179.8°
C22C23C24C25178.4°180.0°
C23C22C21C271.1°0.0°
C22C23C25C261.1°0.0°
C22C23C24H2389.3°90.0°
C22C23C24H24150.7°149.9°
C22C23C24H2530.7°30.0°
C22C23C25H26178.9°180.0°
C23C22N29H280.0°0.1°
C24C23C25C26179.5°180.0°
C23C24H23H24120.0°120.0°
C23C24H23H25120.0°120.0°
C23C24H24H25120.0°120.0°
C24C23C25H260.6°0.0°
C21C27F28C26179.6°179.9°
C21C27C26C250.6°0.0°
C27C21C20H220.8°0.0°
C21C27C26H27179.3°180.0°
C23C25C26C270.8°0.0°
C23C25C26H26180.0°180.0°
C25C23C24H2389.1°90.0°
C25C23C24H2430.9°30.0°
C25C23C24H25150.9°150.0°
C23C25C26H27179.2°180.0°
F28C27C26C25179.8°180.0°
F28C27C26H270.2°0.1°
C27C26C25H27180.0°180.0°
C27C26C25H26179.2°180.0°
H1C1H2H3119.9°120.1°
H5C3H6H7120.0°120.0°
H8C4C5H9173.0°177.8°
H8C4C5H1054.0°57.7°
H8C4C9H15175.6°57.6°
H8C4C9H1664.9°177.7°
H9C5C6H11161.3°59.2°
H9C5C6H1243.7°179.2°
H10C5C6H1142.3°60.9°
H10C5C6H1275.3°59.1°
H13C8C9H15177.8°60.9°
H13C8C9H1662.7°59.2°
H14C8C9H1562.5°59.1°
H14C8C9H1657.0°179.2°
H18C13C14H191.9°0.3°
H19C14C15H201.0°0.5°
H23C24H24H25120.0°120.1°
H26C25C26H270.8°0.0°

222415

PDB entries from 2024-07-10

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