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CVY

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C43N41sing1.46Å1.46Å
N41C42sing1.35Å1.34ÅAromatic
N41N40sing1.40Å1.36ÅAromatic
C42C38doub1.36Å1.40ÅAromatic
N40C39doub1.31Å1.33ÅAromatic
C38C39sing1.41Å1.39ÅAromatic
C38C35sing1.48Å1.41Å
N36C35doub1.31Å1.33ÅAromatic
N36N37sing1.40Å1.39ÅAromatic
C35C02sing1.47Å1.43ÅAromatic
N37C01sing1.37Å1.35ÅAromatic
C02C01doub1.41Å1.37ÅAromatic
C02C03sing1.40Å1.40ÅAromatic
C01C06sing1.39Å1.42ÅAromatic
C03C04doub1.38Å1.37ÅAromatic
C06C05doub1.36Å1.40ÅAromatic
C04N07sing1.40Å1.46Å
C04C05sing1.40Å1.41ÅAromatic
N07C08sing1.35Å1.45Å
C08O09doub1.22Å1.20Å
C08C10sing1.48Å1.54Å
F32C31sing1.40Å1.39Å
C10C15doub1.40Å1.40ÅAromatic
C10C11sing1.40Å1.37ÅAromatic
C15C14sing1.38Å1.40ÅAromatic
C31C11sing1.51Å1.53Å
C31F34sing1.40Å1.37Å
C31F33sing1.40Å1.37Å
C11C12doub1.38Å1.37ÅAromatic
C14C13doub1.39Å1.39ÅAromatic
C12C13sing1.39Å1.38ÅAromatic
C13N16sing1.39Å1.40Å
O18C17doub1.22Å1.18Å
N16C17sing1.35Å1.43Å
C17N19sing1.35Å1.44Å
N19C20sing1.40Å1.44Å
F28C27sing1.40Å1.36Å
F30C27sing1.40Å1.37Å
C21C20doub1.39Å1.37ÅAromatic
C21C22sing1.38Å1.38ÅAromatic
C20C25sing1.39Å1.40ÅAromatic
C27C22sing1.51Å1.50Å
C27F29sing1.40Å1.37Å
C22C23doub1.38Å1.38ÅAromatic
C25F26sing1.35Å1.37Å
C25C24doub1.38Å1.39ÅAromatic
C23C24sing1.38Å1.39ÅAromatic
C12H121sing1.08Å1.08Å
C14H141sing1.08Å1.08Å
C15H151sing1.08Å1.08Å
C21H211sing1.08Å1.08Å
C23H231sing1.08Å1.08Å
C24H241sing1.08Å1.08Å
C03H031sing1.08Å1.08Å
C05H051sing1.08Å1.08Å
C06H061sing1.08Å1.08Å
C39H391sing1.08Å1.08Å
C42H421sing1.08Å1.08Å
C43H431sing1.09Å1.10Å
C43H433sing1.09Å1.10Å
C43H432sing1.09Å1.10Å
N07H071sing0.97Å1.00Å
N16H161sing0.97Å1.00Å
N19H191sing0.97Å1.00Å
N37H371sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C43N41C42126.4°125.9°
C43N41N40125.8°125.9°
N41C43H431109.5°109.5°
N41C43H433109.5°109.5°
N41C43H432109.5°109.5°
C42N41N40107.7°108.2°
N41C42C38109.4°107.6°
N41C42H421125.3°126.1°
N41N40C39109.1°108.5°
C42C38C39104.4°107.6°
C42C38C35127.4°126.2°
C38C42H421125.3°126.2°
N40C39C38109.2°108.1°
N40C39H391125.4°125.9°
C39C38C35127.9°126.2°
C38C39H391125.4°126.0°
C38C35N36126.8°126.2°
C38C35C02128.3°126.2°
C35N36N37110.2°110.0°
N36C35C02104.9°107.6°
N36N37C01109.1°109.3°
N36N37H371125.5°125.4°
C35C02C01109.7°106.3°
C35C02C03131.6°133.8°
N37C01C02106.1°106.9°
N37C01C06133.1°133.5°
C01N37H371125.5°125.3°
C01C02C03118.6°119.8°
C02C01C06120.8°119.6°
C02C03C04121.3°119.5°
C02C03H031119.4°120.2°
C01C06C05120.1°120.1°
C01C06H061120.0°119.9°
C03C04N07113.2°119.9°
C03C04C05121.0°120.3°
C04C03H031119.4°120.3°
C06C05C04118.0°120.7°
C06C05H051121.0°119.7°
C05C06H061120.0°120.0°
N07C04C05125.7°119.8°
C04N07C08123.6°120.1°
C04N07H071118.2°120.0°
C04C05H051121.0°119.6°
N07C08O09119.3°120.0°
N07C08C10127.8°120.1°
C08N07H071118.2°119.9°
O09C08C10112.8°120.0°
C08C10C15121.1°120.0°
C08C10C11117.5°120.1°
F32C31C11111.6°109.5°
F32C31F34112.5°109.5°
F32C31F33107.9°109.5°
C15C10C11121.1°119.9°
C10C15C14119.2°119.9°
C10C15H151120.4°120.1°
C10C11C31122.6°120.0°
C10C11C12119.6°119.9°
C15C14C13118.4°120.1°
C15C14H141120.8°119.9°
C14C15H151120.4°120.0°
C11C31F34109.5°109.4°
C11C31F33104.6°109.5°
C31C11C12117.8°120.1°
F34C31F33110.4°109.4°
C11C12C13120.0°120.2°
C11C12H121120.0°119.9°
C14C13C12120.8°120.1°
C14C13N16125.7°119.9°
C13C14H141120.8°120.0°
C12C13N16110.9°120.0°
C13C12H121119.9°119.9°
C13N16C17121.6°120.1°
C13N16H161119.2°120.0°
O18C17N16122.0°119.9°
O18C17N19127.3°120.0°
N16C17N19110.4°120.0°
C17N16H161119.2°120.0°
C17N19C20127.5°120.0°
C17N19H191116.3°120.0°
N19C20C21123.0°120.1°
N19C20C25116.2°120.1°
C20N19H191116.2°120.0°
F28C27F30110.8°109.4°
F28C27C22106.8°109.5°
F28C27F29112.2°109.5°
F30C27C22106.3°109.5°
F30C27F29111.7°109.5°
C20C21C22118.2°119.9°
C21C20C25120.7°119.9°
C20C21H211120.9°120.0°
C21C22C27116.4°119.9°
C21C22C23122.5°120.1°
C22C21H211120.9°120.0°
C20C25F26121.5°120.1°
C20C25C24120.1°119.9°
C22C27F29108.7°109.5°
C27C22C23121.1°119.9°
C22C23C24119.3°120.2°
C22C23H231120.3°119.9°
F26C25C24118.4°120.1°
C25C24C23119.2°120.1°
C25C24H241120.4°120.0°
C24C23H231120.4°119.9°
C23C24H241120.4°120.0°
H431C43H433109.4°109.4°
H431C43H432109.5°109.5°
H433C43H432109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C43N41C42N40178.3°179.7°
C43N41C42C38179.9°180.0°
C43N41N40C39178.1°179.9°
C43N41C42H4210.0°0.1°
N41C43H431H433120.0°120.0°
N41C43H431H432120.0°120.1°
N41C43H433H432120.0°120.0°
N41C42C38H421180.0°179.9°
C42N41N40C390.2°0.4°
N41C42C38C392.8°0.0°
N41C42C38C35177.4°179.7°
C42N41C43H431178.0°90.0°
C42N41C43H43358.0°150.0°
C42N41C43H43262.0°30.1°
N40N41C42C381.7°0.3°
N41N40C39C382.0°0.4°
N41N40C39H391178.0°179.6°
N40N41C42H421178.3°179.8°
N40N41C43H4310.0°89.6°
N40N41C43H433120.0°30.4°
N40N41C43H432120.0°150.3°
C42C38C39N402.9°0.2°
C42C38C39C35174.6°179.8°
C42C38C35N363.3°35.3°
C42C38C35C02180.0°144.7°
C42C38C39H391177.1°179.8°
N40C39C38H391180.0°180.0°
N40C39C38C35177.5°180.0°
C39C38C35N36170.1°145.0°
C39C38C35C026.6°35.0°
C39C38C42H421177.2°180.0°
C38C35N36C02177.3°180.0°
C38C35N36N37179.4°179.8°
C38C35C02C01179.1°180.0°
C38C35C02C033.8°0.0°
C35C38C39H3912.5°0.0°
C35C38C42H4212.6°0.2°
C35N36N37C011.7°0.4°
N36C35C02C011.9°0.0°
N36C35C02C03179.0°180.0°
C35N36N37H371178.3°180.0°
N37N36C35C022.1°0.2°
N36N37C01H371180.0°179.6°
N36N37C01C020.4°0.4°
N36N37C01C06179.1°179.9°
C35C02C01N370.9°0.2°
C35C02C01C03177.6°180.0°
C35C02C01C06179.5°180.0°
C35C02C03C04179.2°180.0°
C35C02C03H0310.8°0.0°
N37C01C02C06179.6°179.7°
N37C01C02C03178.5°179.8°
N37C01C06C05179.0°179.7°
N37C01C06H0611.0°0.3°
C01C02C03C042.2°0.0°
C02C01C06C050.5°0.0°
C01C02C03H031177.8°180.0°
C02C01C06H061179.5°180.0°
C02C01N37H371179.5°180.0°
C03C02C01C061.9°0.0°
C02C03C04H031180.0°179.9°
C02C03C04N07176.8°180.0°
C02C03C04C050.1°0.1°
C01C06C05H061180.0°180.0°
C01C06C05C042.5°0.0°
C01C06C05H051177.4°180.0°
C06C01N37H3710.9°0.3°
C03C04C05C062.3°0.1°
C03C04N07C05176.7°179.9°
C03C04N07C08159.1°145.2°
C03C04C05H051177.7°180.0°
C03C04N07H07121.0°34.8°
C06C05C04N07178.7°180.0°
C06C05C04H051180.0°180.0°
C04N07C08H071180.0°179.9°
C04N07C08O09179.9°5.4°
C04N07C08C105.5°174.6°
N07C04C03H0313.3°0.1°
N07C04C05H0511.3°0.0°
C05C04N07C0824.2°34.8°
C05C04C03H031179.9°180.0°
C04C05C06H061177.5°180.0°
C05C04N07H071155.8°145.3°
N07C08O09C10175.3°180.0°
N07C08C10C1563.8°0.1°
N07C08C10C11122.4°179.8°
O09C08C10C15111.1°180.0°
O09C08C10C1162.7°0.2°
O09C08N07H0710.1°174.5°
C08C10C15C11173.6°179.7°
C08C10C15C14176.7°179.8°
C08C10C11C315.5°0.3°
C08C10C11C12176.1°179.7°
C08C10C15H1513.3°0.3°
C10C08N07H071174.5°5.5°
F32C31C11C1044.5°60.1°
F32C31C11F34125.2°120.0°
F32C31C11F33116.5°120.1°
F32C31F34F33120.6°120.0°
F32C31C11C12133.9°119.9°
C10C15C14H151180.0°179.9°
C15C10C11C31179.3°180.0°
C15C10C11C122.3°0.0°
C10C15C14C133.0°0.1°
C10C15C14H141177.1°180.0°
C11C10C15C143.2°0.1°
C10C11C31C12178.4°180.0°
C10C11C31F3480.7°179.9°
C10C11C31F33161.0°60.0°
C10C11C12C134.8°0.0°
C10C11C12H121175.2°180.0°
C11C10C15H151176.8°180.0°
C15C14C13H141180.0°179.9°
C15C14C13C1210.0°0.1°
C15C14C13N16169.8°179.9°
C11C31F34F33114.7°120.0°
C31C11C12C13173.7°180.0°
C31C11C12H1216.3°0.1°
F34C31C11C12100.9°0.1°
F33C31C11C1217.4°120.0°
C11C12C13C1411.1°0.0°
C11C12C13H121180.0°180.0°
C11C12C13N16173.5°180.0°
C14C13C12N16162.4°180.0°
C14C13N16C170.9°35.1°
C14C13C12H121168.9°180.0°
C13C14C15H151177.0°180.0°
C14C13N16H161179.1°144.8°
C12C13N16C17160.5°144.9°
C12C13C14H141170.0°180.0°
C12C13N16H16119.5°35.2°
C13N16C17O1814.4°4.6°
C13N16C17H161180.0°180.0°
C13N16C17N19171.7°175.4°
N16C13C12H1216.5°0.0°
N16C13C14H14110.3°0.0°
O18C17N16N19173.9°180.0°
O18C17N19C206.0°4.6°
O18C17N16H161165.6°175.4°
O18C17N19H191174.0°175.4°
N16C17N19C20179.5°175.4°
N16C17N19H1910.5°4.6°
C17N19C20H191180.0°180.0°
C17N19C20C2128.8°34.7°
C17N19C20C25147.2°145.0°
N19C17N16H1618.3°4.6°
N19C20C21C25175.8°179.7°
N19C20C21C22179.7°179.7°
N19C20C25F261.3°0.3°
N19C20C25C24178.8°179.8°
N19C20C21H2110.3°0.3°
F28C27F30C22115.7°120.0°
F28C27F30F29126.0°120.0°
F28C27C22C2148.8°30.0°
F28C27C22F29121.3°120.0°
F28C27C22C23133.0°150.0°
F30C27C22C2169.6°150.0°
F30C27C22F29120.3°120.0°
F30C27C22C23108.6°30.0°
C20C21C22H211180.0°180.0°
C20C21C22C27178.7°180.0°
C20C21C22C233.2°0.0°
C21C20C25F26177.3°180.0°
C21C20C25C242.7°0.1°
C21C20N19H191151.2°145.3°
C22C21C20C253.9°0.0°
C21C22C27C23178.2°180.0°
C21C22C27F29170.1°90.0°
C21C22C23C241.1°0.1°
C21C22C23H231179.0°180.0°
C20C25F26C24180.0°179.9°
C20C25C24C230.5°0.1°
C25C20C21H211176.1°180.0°
C20C25C24H241179.5°180.0°
C25C20N19H19132.8°35.0°
C27C22C23C24179.1°180.0°
C27C22C21H2111.3°0.0°
C27C22C23H2310.9°0.0°
F29C27C22C2311.7°90.0°
C22C23C24C250.3°0.1°
C22C23C24H231180.0°179.9°
C23C22C21H211176.8°180.0°
C22C23C24H241179.7°180.0°
F26C25C24C23179.5°180.0°
F26C25C24H2410.5°0.1°
C25C24C23H241180.0°179.9°
C25C24C23H231179.7°180.0°
H141C14C15H1512.9°0.1°
H231C23C24H2410.3°0.1°
H051C05C06H0612.5°0.0°
H431C43H433H432120.0°120.0°

222415

PDB entries from 2024-07-10

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