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XY8

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C01C02sing1.53Å1.52Å
C03C02sing1.53Å1.53Å
C02N04sing1.47Å1.47Å
C27C28doub1.38Å1.39ÅAromatic
C27C25sing1.39Å1.39ÅAromatic
C28C21sing1.38Å1.40ÅAromatic
N04C05sing1.38Å1.41Å
F26C25sing1.35Å1.34Å
C25C24doub1.38Å1.39ÅAromatic
C29C30sing1.53Å1.52Å
C29N19sing1.47Å1.51Å
C21C20sing1.51Å1.51Å
C21C22doub1.38Å1.40ÅAromatic
C20N19sing1.47Å1.52Å
C30N16sing1.47Å1.46Å
C05N06doub1.32Å1.36ÅAromatic
C05C15sing1.42Å1.41ÅAromatic
C24C22sing1.38Å1.39ÅAromatic
N19C18sing1.47Å1.51Å
N06C07sing1.34Å1.35ÅAromatic
C22F23sing1.35Å1.34Å
N16C15sing1.39Å1.43Å
N16C17sing1.47Å1.47Å
C18C17sing1.53Å1.53Å
C15N14doub1.32Å1.36ÅAromatic
C07C13doub1.41Å1.40ÅAromatic
C07C08sing1.42Å1.40ÅAromatic
C13C11sing1.36Å1.40ÅAromatic
N14C08sing1.34Å1.35ÅAromatic
C08C09doub1.40Å1.39ÅAromatic
C11C12sing1.51Å1.50Å
C11N10doub1.32Å1.35ÅAromatic
C09N10sing1.31Å1.35ÅAromatic
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C01H3sing1.09Å1.10Å
C02H4sing1.09Å1.10Å
C03H5sing1.09Å1.10Å
C03H6sing1.09Å1.10Å
C03H7sing1.09Å1.10Å
C09H8sing1.08Å1.08Å
C12H9sing1.09Å1.10Å
C12H10sing1.09Å1.10Å
C12H11sing1.09Å1.10Å
C13H12sing1.08Å1.08Å
C17H13sing1.09Å1.10Å
C17H14sing1.09Å1.10Å
C18H15sing1.09Å1.10Å
C18H16sing1.09Å1.10Å
C20H17sing1.09Å1.10Å
C20H18sing1.09Å1.10Å
C24H19sing1.08Å1.08Å
C27H20sing1.08Å1.08Å
C28H21sing1.08Å1.08Å
C29H22sing1.09Å1.10Å
C29H23sing1.09Å1.10Å
C30H24sing1.09Å1.10Å
C30H25sing1.09Å1.10Å
N04H26sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C01C02C03111.1°109.5°
C01C02N04107.5°109.5°
C02C01H1109.5°109.5°
C02C01H2109.5°109.5°
C02C01H3109.5°109.4°
C01C02H4109.2°109.4°
C03C02N04109.8°109.5°
C03C02H4109.2°109.5°
C02C03H5109.5°109.4°
C02C03H6109.5°109.5°
C02C03H7109.5°109.5°
C02N04C05122.8°120.0°
N04C02H4110.0°109.5°
C02N04H26106.1°120.0°
C28C27C25119.4°120.1°
C27C28C21120.9°120.0°
C28C27H20120.3°120.0°
C27C28H21119.5°120.0°
C27C25F26119.1°120.0°
C27C25C24121.1°119.9°
C25C27H20120.3°120.0°
C28C21C20120.4°120.0°
C28C21C22118.2°120.1°
C21C28H21119.5°120.0°
N04C05N06119.9°119.8°
N04C05C15119.6°119.8°
C05N04H26106.0°120.1°
F26C25C24119.8°120.1°
C25C24C22119.0°120.0°
C25C24H19120.5°120.0°
C30C29N19108.6°109.4°
C29C30N16109.6°109.4°
C30C29H22109.7°109.5°
C30C29H23109.7°109.5°
C29C30H24109.4°109.4°
C29C30H25109.5°109.5°
C29N19C20113.3°111.0°
C29N19C18109.9°110.9°
N19C29H22109.7°109.5°
N19C29H23109.7°109.5°
C20C21C22121.4°120.0°
C21C20N19112.0°109.5°
C21C20H17108.8°109.5°
C21C20H18108.9°109.5°
C21C22C24121.4°120.0°
C21C22F23119.9°120.0°
C20N19C18113.3°111.0°
N19C20H17108.9°109.4°
N19C20H18108.8°109.5°
C30N16C15114.2°111.0°
C30N16C17114.3°110.9°
N16C30H24109.4°109.5°
N16C30H25109.4°109.5°
N06C05C15120.5°120.4°
C05N06C07119.6°119.6°
C05C15N16121.2°119.8°
C05C15N14119.5°120.5°
C24C22F23118.7°120.0°
C22C24H19120.5°120.0°
N19C18C17109.7°109.3°
N19C18H15109.4°109.5°
N19C18H16109.4°109.5°
N06C07C13121.2°121.7°
N06C07C08119.9°120.1°
C15N16C17115.7°111.0°
N16C15N14119.3°119.7°
N16C17C18110.0°109.4°
N16C17H13109.4°109.5°
N16C17H14109.4°109.5°
C18C17H13109.3°109.4°
C18C17H14109.3°109.5°
C17C18H15109.4°109.5°
C17C18H16109.4°109.5°
C15N14C08119.6°119.7°
C13C07C08118.9°118.2°
C07C13C11119.4°118.8°
C07C13H12120.3°120.6°
C07C08N14120.9°119.8°
C07C08C09117.4°118.6°
C13C11C12120.0°119.1°
C13C11N10122.5°121.8°
C11C13H12120.3°120.6°
N14C08C09121.8°121.7°
C08C09N10124.7°120.0°
C08C09H8117.7°120.0°
C12C11N10117.6°119.1°
C11C12H9109.5°109.4°
C11C12H10109.5°109.5°
C11C12H11109.5°109.5°
C11N10C09117.1°122.6°
N10C09H8117.7°120.0°
H1C01H2109.5°109.5°
H1C01H3109.4°109.5°
H2C01H3109.5°109.4°
H5C03H6109.5°109.5°
H5C03H7109.5°109.4°
H6C03H7109.4°109.5°
H9C12H10109.4°109.5°
H9C12H11109.5°109.5°
H10C12H11109.5°109.5°
H13C17H14109.4°109.5°
H15C18H16109.5°109.5°
H17C20H18109.5°109.4°
H22C29H23109.5°109.4°
H24C30H25109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C01C02C03N04118.8°120.0°
C01C02C03H4120.5°120.0°
C01C02N04H4118.9°120.0°
C01C02N04C05154.0°85.0°
C02C01H1H2120.0°120.0°
C02C01H1H3120.0°120.0°
C02C01H2H3120.0°119.9°
C01C02C03H5180.0°60.0°
C01C02C03H660.0°180.0°
C01C02C03H760.0°60.0°
C01C02N04H2632.2°95.0°
C03C02N04H4120.2°120.0°
C03C02N04C0585.0°155.0°
C03C02C01H1180.0°60.0°
C03C02C01H260.0°60.0°
C03C02C01H360.0°179.9°
C02C03H5H6120.0°120.0°
C02C03H5H7120.0°120.0°
C02C03H6H7120.0°120.0°
C03C02N04H26153.2°25.0°
C02N04C05H26121.8°180.0°
C02N04C05N0620.8°5.3°
C02N04C05C15159.2°175.0°
N04C02C01H159.8°60.0°
N04C02C01H2179.8°180.0°
N04C02C01H360.2°60.1°
N04C02C03H561.2°60.0°
N04C02C03H658.8°60.0°
N04C02C03H7178.8°180.0°
C28C27C25H20180.0°179.4°
C27C28C21H21180.0°179.4°
C28C27C25F26179.9°179.8°
C28C27C25C240.0°0.3°
C27C28C21C20179.2°179.7°
C27C28C21C220.3°0.6°
C25C27C28C210.1°0.6°
C27C25F26C24179.9°180.0°
C27C25C24C220.1°0.0°
C27C25C24H19179.9°180.0°
C25C27C28H21179.9°180.0°
C28C21C20C22178.8°179.7°
C28C21C20N1983.7°100.3°
C28C21C22C240.5°0.3°
C28C21C22F23179.8°179.8°
C28C21C20H1736.6°19.7°
C28C21C20H18155.9°139.7°
C21C28C27H20179.9°180.0°
N04C05N06C15179.9°179.7°
N04C05N06C07180.0°179.7°
N04C05C15N160.2°0.3°
N04C05C15N14179.9°179.7°
C05N04C02H435.2°34.9°
F26C25C24C22180.0°180.0°
F26C25C24H190.0°0.0°
F26C25C27H200.1°0.3°
C25C24C22C210.3°0.0°
C25C24C22H19180.0°180.0°
C25C24C22F23179.9°179.9°
C24C25C27H20180.0°179.7°
C30C29N19H22119.9°120.0°
C30C29N19H23119.9°120.0°
C30C29N19C20171.4°176.8°
C29C30N16H24120.0°119.9°
C29C30N16H25120.0°120.0°
C30C29N19C1860.7°59.3°
C29C30N16C15166.0°176.8°
C29C30N16C1757.6°59.3°
C30C29H22H23120.4°120.1°
C29C30H24H25120.0°120.0°
C29N19C20C2172.7°170.0°
C29N19C20C18126.1°123.8°
N19C29C30N1658.6°58.4°
C29N19C18C1759.0°59.3°
C29N19C18H1561.0°179.2°
C29N19C18H16179.0°60.7°
C29N19C20H1747.7°50.0°
C29N19C20H18166.9°70.0°
N19C29H22H23120.4°120.0°
N19C29C30H2461.4°61.6°
N19C29C30H25178.6°178.4°
C21C20N19H17120.4°120.0°
C21C20N19H18120.4°120.1°
C20C21C22C24179.3°180.0°
C21C20N19C18161.2°66.2°
C20C21C22F230.9°0.1°
C21C20H17H18118.9°120.0°
C20C21C28H210.8°0.3°
C22C21C20N1995.1°80.0°
C21C22C24F23179.7°179.9°
C22C21C20H17144.5°160.0°
C22C21C20H1825.3°40.0°
C21C22C24H19179.7°180.0°
C22C21C28H21179.6°180.0°
C20N19C18C17173.1°176.8°
C20N19C18H1566.9°56.9°
C20N19C18H1653.1°63.2°
N19C20H17H18118.9°120.0°
C20N19C29H2268.7°63.2°
C20N19C29H2351.5°56.8°
C30N16C15C0570.2°119.1°
C30N16C15C17135.7°123.8°
C30N16C17C1855.5°59.4°
C30N16C15N14109.4°60.9°
C30N16C17H1364.6°179.3°
C30N16C17H14175.6°60.6°
N16C30C29H2261.3°61.6°
N16C30C29H23178.5°178.4°
N16C30H24H25119.9°120.1°
N06C05C15N16179.7°180.0°
N06C05C15N140.1°0.0°
C05N06C07C13179.9°180.0°
C05N06C07C080.1°0.0°
N06C05N04H26101.1°174.6°
C15C05N06C070.1°0.0°
C05C15N16N14179.6°180.0°
C05C15N16C17154.0°117.1°
C05C15N14C080.1°0.0°
C15C05N04H2679.0°5.1°
N19C18C17N1654.8°58.4°
N19C18C17H15120.0°119.9°
N19C18C17H16120.1°120.0°
N19C18C17H1365.3°178.4°
N19C18C17H14174.9°61.6°
N19C18H15H16119.9°120.1°
C18N19C20H1778.4°173.8°
C18N19C20H1840.9°53.9°
C18N19C29H2259.2°60.7°
C18N19C29H23179.4°179.3°
N06C07C13C08180.0°180.0°
N06C07C13C11180.0°180.0°
N06C07C08N140.0°0.0°
N06C07C08C09180.0°180.0°
N06C07C13H120.1°0.0°
F23C22C24H190.1°0.1°
C15N16C17C18168.8°176.8°
N16C15N14C08179.8°180.0°
C15N16C17H1371.1°56.9°
C15N16C17H1448.7°63.2°
C15N16C30H2474.0°63.2°
C15N16C30H2546.0°56.8°
N16C17C18H13120.1°119.9°
N16C17C18H14120.1°120.0°
C17N16C15N1426.3°62.9°
N16C17H13H14119.8°120.1°
N16C17C18H1565.2°178.4°
N16C17C18H16174.8°61.6°
C17N16C30H2462.4°60.6°
C17N16C30H25177.6°179.3°
C18C17H13H14119.7°120.0°
C17C18H15H16119.9°120.1°
C15N14C08C070.1°0.0°
C15N14C08C09179.9°180.0°
C07C13C11H12180.0°180.0°
C13C07C08N14180.0°180.0°
C13C07C08C090.0°0.0°
C07C13C11C12180.0°180.0°
C07C13C11N100.0°0.0°
C08C07C13C110.0°0.0°
C07C08N14C09180.0°180.0°
C07C08C09N100.0°0.1°
C07C08C09H8180.0°180.0°
C08C07C13H12179.9°180.0°
C13C11C12N10180.0°180.0°
C13C11N10C090.0°0.1°
C13C11C12H9180.0°90.1°
C13C11C12H1060.1°30.0°
C13C11C12H1160.0°150.0°
N14C08C09N10180.0°179.9°
N14C08C09H80.0°0.0°
C08C09N10C110.0°0.1°
C08C09N10H8180.0°179.9°
C12C11N10C09180.0°180.0°
C11C12H9H10120.0°120.0°
C11C12H9H11120.0°120.0°
C11C12H10H11120.0°120.0°
C12C11C13H120.0°0.0°
C11N10C09H8180.0°180.0°
N10C11C12H90.0°90.0°
N10C11C12H10120.0°150.0°
N10C11C12H11120.0°30.0°
N10C11C13H12180.0°180.0°
H1C01H2H3119.9°120.1°
H1C01C02H459.6°180.0°
H2C01C02H460.5°60.0°
H3C01C02H4179.6°59.9°
H4C02C03H559.5°179.9°
H4C02C03H6179.5°60.1°
H4C02C03H760.5°60.0°
H4C02N04H2686.7°145.0°
H5C03H6H7120.0°120.0°
H9C12H10H11120.0°120.0°
H13C17C18H15174.6°61.7°
H13C17C18H1654.7°58.4°
H14C17C18H1554.9°58.3°
H14C17C18H1665.1°178.4°
H20C27C28H210.1°0.6°
H22C29C30H24178.7°178.4°
H22C29C30H2558.8°58.4°
H23C29C30H2458.5°58.4°
H23C29C30H2561.5°61.6°

250359

PDB entries from 2026-03-11

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