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CQQ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C17C16doub1.38Å1.40ÅAromatic
C17C18sing1.38Å1.41ÅAromatic
O22C21doub1.22Å1.22Å
C16C14sing1.39Å1.41ÅAromatic
C18C19doub1.39Å1.39ÅAromatic
C26C27doub1.38Å1.40ÅAromatic
C26C23sing1.40Å1.40ÅAromatic
C21C23sing1.48Å1.50Å
C21N20sing1.35Å1.37Å
C27C28sing1.39Å1.40ÅAromatic
C23C24doub1.40Å1.40ÅAromatic
C19C15sing1.39Å1.40ÅAromatic
C19N20sing1.40Å1.41Å
C14N13sing1.40Å1.43Å
C14C15doub1.39Å1.40ÅAromatic
C28N29sing1.39Å1.42Å
C28C25doub1.39Å1.40ÅAromatic
C24C25sing1.38Å1.40ÅAromatic
O31C30doub1.21Å1.22Å
N13C12sing1.38Å1.42Å
N29C30sing1.35Å1.38Å
C30C32sing1.51Å1.51Å
C12N08doub1.32Å1.36ÅAromatic
C12N11sing1.33Å1.36ÅAromatic
N08C07sing1.33Å1.36ÅAromatic
C01N02doub1.32Å1.35ÅAromatic
C01C06sing1.39Å1.41ÅAromatic
N02C03sing1.32Å1.34ÅAromatic
N11C10doub1.32Å1.35ÅAromatic
C07C06sing1.48Å1.48Å
C07C09doub1.40Å1.39ÅAromatic
C06C05doub1.40Å1.39ÅAromatic
C03C04doub1.38Å1.40ÅAromatic
C10C09sing1.38Å1.39ÅAromatic
C05C04sing1.38Å1.40ÅAromatic
C32C33sing1.53Å1.52Å
C33C34sing1.53Å1.53Å
C34N35sing1.47Å1.47Å
N35C37sing1.47Å1.48Å
N35C36sing1.47Å1.48Å
C01H1sing1.08Å1.08Å
C03H2sing1.08Å1.08Å
C04H3sing1.08Å1.08Å
C05H4sing1.08Å1.08Å
C09H5sing1.08Å1.08Å
C10H6sing1.08Å1.08Å
N13H7sing0.97Å1.00Å
C15H8sing1.08Å1.08Å
C16H9sing1.08Å1.08Å
C17H10sing1.08Å1.08Å
C18H11sing1.08Å1.08Å
N20H12sing0.97Å1.00Å
C24H13sing1.08Å1.08Å
C25H14sing1.08Å1.08Å
C26H15sing1.08Å1.08Å
C27H16sing1.08Å1.08Å
N29H17sing0.97Å1.00Å
C32H18sing1.09Å1.10Å
C32H19sing1.09Å1.10Å
C33H20sing1.09Å1.10Å
C34H21sing1.09Å1.10Å
C34H22sing1.09Å1.10Å
C36H24sing1.09Å1.10Å
C36H25sing1.09Å1.10Å
C36H26sing1.09Å1.10Å
C37H27sing1.09Å1.10Å
C37H28sing1.09Å1.10Å
C37H29sing1.09Å1.10Å
C33H30sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C16C17C18120.5°120.2°
C17C16C14120.1°120.0°
C17C16H9120.0°120.0°
C16C17H10119.7°119.9°
C17C18C19119.9°120.1°
C18C17H10119.8°119.9°
C17C18H11120.1°120.0°
O22C21C23120.5°120.0°
O22C21N20120.9°120.0°
C16C14N13119.7°120.0°
C16C14C15118.1°120.0°
C14C16H9120.0°120.0°
C18C19C15118.9°119.9°
C18C19N20122.2°120.1°
C19C18H11120.1°119.9°
C27C26C23119.7°119.9°
C26C27C28120.9°120.1°
C27C26H15120.1°120.0°
C26C27H16119.6°120.0°
C26C23C21120.3°120.1°
C26C23C24119.9°119.9°
C23C26H15120.1°120.0°
C23C21N20118.6°120.0°
C21C23C24119.8°120.1°
C21N20C19114.4°120.0°
C21N20H12122.8°120.0°
C27C28N29118.3°119.9°
C27C28C25118.9°120.1°
C28C27H16119.6°120.0°
C23C24C25120.3°120.0°
C23C24H13119.9°120.0°
C15C19N20118.8°120.0°
C19C15C14122.3°119.8°
C19C15H8118.9°120.0°
C19N20H12122.8°120.0°
N13C14C15122.2°120.0°
C14N13C12117.2°120.0°
C14N13H7121.4°120.0°
C14C15H8118.9°120.1°
N29C28C25122.7°119.9°
C28N29C30113.5°120.0°
C28N29H17123.2°120.0°
C28C25C24120.3°120.1°
C28C25H14119.8°120.0°
C25C24H13119.8°120.0°
C24C25H14119.9°120.0°
O31C30N29119.9°120.0°
O31C30C32120.1°120.0°
N13C12N08123.0°119.2°
N13C12N11118.7°119.1°
C12N13H7121.4°120.0°
N29C30C32120.0°120.0°
C30N29H17123.2°120.0°
C30C32C33111.5°109.5°
C30C32H18109.0°109.5°
C30C32H19108.9°109.4°
N08C12N11118.3°121.7°
C12N08C07121.6°120.6°
C12N11C10122.2°121.0°
N08C07C06119.4°120.5°
N08C07C09120.0°119.0°
N02C01C06121.1°120.6°
C01N02C03120.9°121.8°
N02C01H1119.4°119.7°
C01C06C07120.5°120.5°
C01C06C05119.2°118.9°
C06C01H1119.5°119.8°
N02C03C04120.4°121.1°
N02C03H2119.8°119.5°
N11C10C09120.0°119.3°
N11C10H6120.0°120.4°
C06C07C09120.5°120.5°
C07C06C05120.2°120.6°
C07C09C10117.9°118.5°
C07C09H5121.1°120.8°
C06C05C04118.0°118.3°
C06C05H4121.0°120.9°
C03C04C05120.4°119.3°
C04C03H2119.8°119.4°
C03C04H3119.8°120.4°
C10C09H5121.1°120.7°
C09C10H6120.0°120.4°
C05C04H3119.8°120.4°
C04C05H4121.0°120.8°
C32C33C34105.7°109.5°
C33C32H18109.0°109.5°
C33C32H19109.0°109.5°
C32C33H20110.4°109.4°
C32C33H30110.4°109.5°
C33C34N35115.3°109.5°
C34C33H20110.4°109.5°
C33C34H21108.0°109.5°
C33C34H22108.0°109.5°
C34C33H30110.4°109.5°
C34N35C37107.6°111.0°
C34N35C36109.6°111.0°
N35C34H21108.0°109.4°
N35C34H22108.0°109.5°
C37N35C36111.7°111.0°
N35C37H27109.5°109.5°
N35C37H28109.5°109.5°
N35C37H29109.5°109.4°
N35C36H24109.5°109.4°
N35C36H25109.4°109.5°
N35C36H26109.5°109.5°
H18C32H19109.5°109.5°
H20C33H30109.4°109.4°
H21C34H22109.5°109.4°
H24C36H25109.5°109.5°
H24C36H26109.5°109.4°
H25C36H26109.5°109.5°
H27C37H28109.4°109.5°
H27C37H29109.5°109.4°
H28C37H29109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C16C17C18H10180.0°179.9°
C17C16C14H9180.0°180.0°
C16C17C18C191.4°0.3°
C17C16C14N13179.6°180.0°
C17C16C14C151.2°0.3°
C16C17C18H11178.5°179.9°
C18C17C16C140.3°0.0°
C17C18C19H11180.0°179.7°
C17C18C19C154.5°0.3°
C17C18C19N20179.3°180.0°
C18C17C16H9179.8°180.0°
O22C21C23C26107.5°179.7°
O22C21C23N20179.2°180.0°
O22C21C23C2474.5°0.0°
O22C21N20C1962.0°4.8°
O22C21N20H12118.0°175.3°
C16C14C15C194.5°0.2°
C16C14N13C15179.2°179.7°
C16C14N13C12152.2°33.8°
C16C14N13H727.8°146.3°
C16C14C15H8175.5°179.7°
C14C16C17H10179.8°180.0°
C18C19N20C2134.2°144.5°
C18C19C15N20176.3°179.7°
C18C19C15C146.2°0.0°
C18C19C15H8173.8°180.0°
C19C18C17H10178.5°179.7°
C18C19N20H12145.8°35.5°
C27C26C23H15180.0°179.9°
C27C26C23C21179.7°180.0°
C26C27C28H16180.0°180.0°
C27C26C23C241.7°0.2°
C26C27C28N29179.8°180.0°
C26C27C28C250.6°0.2°
C26C23C21C24178.0°179.7°
C26C23C21N2073.2°0.3°
C23C26C27C281.1°0.0°
C26C23C24C251.9°0.3°
C26C23C24H13178.1°179.8°
C23C26C27H16178.9°180.0°
C23C21N20C19118.7°175.3°
C21C23C24C25179.9°180.0°
C23C21N20H1261.3°4.7°
C21C23C24H130.1°0.0°
C21C23C26H150.3°0.0°
N20C21C23C24104.8°180.0°
C21N20C19C15149.7°35.8°
C21N20C19H12180.0°180.0°
C27C28N29C25179.3°179.8°
C27C28C25C240.7°0.2°
C27C28N29C30176.6°143.7°
C27C28C25H14179.3°179.8°
C28C27C26H15178.9°179.9°
C27C28N29H173.4°36.3°
C23C24C25C281.4°0.0°
C23C24C25H13180.0°180.0°
C23C24C25H14178.7°180.0°
C24C23C26H15178.3°179.7°
C19C15C14N13176.3°179.9°
C19C15C14H8180.0°180.0°
C15C19C18H11175.5°180.0°
C15C19N20H1230.3°144.2°
N20C19C15C14177.6°179.7°
N20C19C15H82.4°0.3°
N20C19C18H110.7°0.3°
C14N13C12H7180.0°179.9°
C14N13C12N085.6°174.9°
C14N13C12N11174.4°5.1°
N13C14C15H83.7°0.0°
N13C14C16H90.5°0.1°
C15C14N13C1228.5°146.5°
C15C14N13H7151.4°33.4°
C15C14C16H9178.8°179.7°
N29C28C25C24179.9°180.0°
C28N29C30O31110.8°4.7°
C28N29C30H17180.0°180.0°
C28N29C30C3269.3°175.4°
N29C28C25H140.1°0.0°
N29C28C27H160.1°0.0°
C28C25C24H14180.0°180.0°
C25C28N29C304.1°36.5°
C28C25C24H13178.6°180.0°
C25C28C27H16179.4°179.8°
C25C28N29H17175.9°143.5°
O31C30N29C32180.0°179.9°
O31C30C32C3397.1°0.0°
O31C30N29H1769.2°175.3°
O31C30C32H18142.6°119.9°
O31C30C32H1923.3°120.0°
N13C12N08N11180.0°180.0°
N13C12N08C07178.6°180.0°
N13C12N11C10178.1°179.7°
N29C30C32C3382.9°180.0°
N29C30C32H1837.4°60.0°
N29C30C32H19156.8°60.1°
C30C32C33H18120.3°120.0°
C30C32C33H19120.3°119.9°
C30C32C33C34125.5°180.0°
C32C30N29H17110.7°4.6°
C30C32H18H19119.0°119.9°
C30C32C33H206.1°60.0°
C30C32C33H30115.1°60.0°
N08C12N11C101.9°0.3°
C12N08C07C06176.1°180.0°
C12N08C07C090.2°0.2°
N08C12N13H7174.4°5.1°
N11C12N08C071.4°0.1°
C12N11C10C091.1°0.3°
C12N11C10H6178.9°179.7°
N11C12N13H75.6°174.8°
N08C07C06C015.1°174.7°
N08C07C06C09176.3°179.7°
N08C07C06C05178.6°5.3°
N08C07C09C100.6°0.3°
N08C07C09H5179.4°179.7°
N02C01C06H1180.0°179.8°
N02C01C06C07178.2°180.0°
N02C01C06C051.9°0.0°
C01N02C03C041.8°0.0°
C01N02C03H2178.2°180.0°
C06C01N02C031.9°0.0°
C01C06C07C05176.2°180.0°
C01C06C07C09171.1°5.0°
C01C06C05C041.8°0.1°
C01C06C05H4178.2°180.0°
N02C03C04H2180.0°180.0°
N02C03C04C051.7°0.0°
C03N02C01H1178.1°179.7°
N02C03C04H3178.3°180.0°
N11C10C09C070.2°0.0°
N11C10C09H6180.0°180.0°
N11C10C09H5179.8°180.0°
C06C07C09C10176.9°180.0°
C07C06C05C04178.1°180.0°
C07C06C01H11.8°0.3°
C07C06C05H41.9°0.0°
C06C07C09H53.1°0.0°
C09C07C06C055.1°175.0°
C07C09C10H5180.0°180.0°
C07C09C10H6179.8°180.0°
C06C05C04C031.7°0.0°
C06C05C04H4180.0°180.0°
C05C06C01H1178.0°179.7°
C06C05C04H3178.3°180.0°
C03C04C05H3180.0°180.0°
C03C04C05H4178.2°180.0°
C05C04C03H2178.3°180.0°
C32C33C34H20119.4°119.9°
C32C33C34H30119.4°120.0°
C32C33C34N35134.2°180.0°
C33C32H18H19119.1°120.1°
C32C33H20H30121.8°120.0°
C32C33C34H2113.4°60.1°
C32C33C34H22104.9°60.0°
C33C34N35H21120.9°120.0°
C33C34N35H22120.8°120.1°
C33C34N35C37112.4°66.1°
C33C34N35C36125.9°170.0°
C34C33C32H18114.2°60.1°
C34C33C32H195.2°60.0°
C34C33H20H30121.7°120.1°
C33C34H21H22117.3°120.1°
C34N35C37C36120.4°124.0°
N35C34C33H20106.3°60.1°
N35C34H21H22117.3°120.0°
C34N35C36H24180.0°59.9°
C34N35C36H2560.0°179.9°
C34N35C36H2660.0°60.0°
C34N35C37H27180.0°60.0°
C34N35C37H2860.0°180.0°
C34N35C37H2960.0°60.0°
N35C34C33H3014.8°59.9°
C37N35C34H21126.7°174.0°
C37N35C34H228.4°54.0°
C37N35C36H2460.8°64.0°
C37N35C36H25179.2°56.0°
C37N35C36H2659.2°176.1°
N35C37H27H28120.0°120.1°
N35C37H27H29120.0°119.9°
N35C37H28H29120.0°120.0°
C36N35C34H215.0°50.0°
C36N35C34H22113.3°69.9°
N35C36H24H25120.0°120.0°
N35C36H24H26120.0°120.0°
N35C36H25H26120.0°120.0°
C36N35C37H2759.6°176.0°
C36N35C37H2860.4°56.0°
C36N35C37H29179.6°64.0°
H2C03C04H31.7°0.0°
H3C04C05H41.7°0.0°
H5C09C10H60.2°0.0°
H9C16C17H100.2°0.0°
H10C17C18H111.5°0.0°
H13C24C25H141.3°0.0°
H15C26C27H161.1°0.0°
H18C32C33H20126.4°180.0°
H18C32C33H305.2°60.0°
H19C32C33H20114.2°60.0°
H19C32C33H30124.6°179.9°
H20C33C34H21132.8°180.0°
H20C33C34H2214.5°60.0°
H21C34C33H30106.0°60.0°
H22C34C33H30135.7°NaN°
H24C36H25H26120.0°120.0°
H27C37H28H29120.0°120.0°

223532

PDB entries from 2024-08-07

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