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SummaryGeometryRelated PDB entries

A1CNG

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C02C01sing1.53Å1.54Å
O03C02sing1.43Å1.43Å
C04O03sing1.36Å1.44Å
C05C04doub1.40Å1.37ÅAromatic
O06C05sing1.36Å1.40Å
C07C05sing1.37Å1.42ÅAromatic
C08C07doub1.40Å1.43ÅAromatic
C09C08sing1.42Å1.37ÅAromatic
C10C09doub1.40Å1.44ÅAromatic
N11C09sing1.34Å1.38ÅAromatic
C12N11doub1.31Å1.37ÅAromatic
N13C12sing1.32Å1.36ÅAromatic
C14N13doub1.33Å1.34ÅAromatic
N15C14sing1.38Å1.47Å
C16N15sing1.40Å1.45Å
C17C16doub1.39Å1.38ÅAromatic
C20C19sing1.38Å1.39ÅAromatic
C21C20doub1.38Å1.39ÅAromatic
C19C18doub1.38Å1.39ÅAromatic
BR22C18sing1.89Å1.95Å
C18C17sing1.38Å1.39ÅAromatic
F23C17sing1.35Å1.37Å
C01O06sing1.43Å1.39Å
C04C10sing1.38Å1.44ÅAromatic
C08C14sing1.42Å1.41ÅAromatic
C16C21sing1.39Å1.39ÅAromatic
C10H101sing1.08Å1.08Å
C20H201sing1.08Å1.08Å
C21H211sing1.08Å1.08Å
C01H011sing1.09Å1.10Å
C01H012sing1.09Å1.10Å
C02H021sing1.09Å1.10Å
C02H022sing1.09Å1.10Å
C07H071sing1.08Å1.08Å
C12H121sing1.08Å1.08Å
C19H191sing1.08Å1.08Å
N15H151sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C01C02O03116.7°108.2°
C02C01O06114.4°108.2°
C02C01H011108.2°109.7°
C02C01H012108.2°109.7°
C01C02H021107.7°109.7°
C01C02H022107.6°109.7°
C02O03C04116.7°116.8°
O03C02H021107.6°109.7°
O03C02H022107.7°109.8°
O03C04C05120.6°120.6°
O03C04C10118.5°118.8°
C04C05O06123.0°120.6°
C04C05C07119.8°120.6°
C05C04C10120.9°120.6°
O06C05C07117.2°118.8°
C05O06C01114.1°116.7°
C05C07C08119.6°119.9°
C05C07H071120.2°120.1°
C07C08C09121.2°119.8°
C07C08C14118.4°122.0°
C08C07H071120.2°120.1°
C08C09C10119.4°119.4°
C08C09N11118.6°118.7°
C09C08C14120.5°118.1°
C10C09N11122.0°121.8°
C09C10C04119.1°119.7°
C09C10H101120.4°120.2°
C09N11C12119.8°120.4°
N11C12N13121.7°122.9°
N11C12H121119.1°118.5°
C12N13C14119.7°121.5°
N13C12H121119.1°118.6°
N13C14N15122.9°120.9°
N13C14C08119.7°118.2°
C14N15C16119.6°120.0°
N15C14C08117.3°120.9°
C14N15H151120.2°120.0°
N15C16C17117.6°120.1°
N15C16C21121.8°120.1°
C16N15H151120.2°120.0°
C16C17C18119.6°119.8°
C16C17F23119.6°120.0°
C17C16C21120.6°119.8°
C19C20C21120.1°120.1°
C20C19C18119.8°120.2°
C19C20H201120.0°120.0°
C20C19H191120.1°119.9°
C20C21C16119.7°120.0°
C21C20H201119.9°119.9°
C20C21H211120.2°120.0°
C19C18BR22121.5°120.0°
C19C18C17120.2°120.0°
C18C19H191120.1°119.9°
BR22C18C17118.3°119.9°
C18C17F23120.8°120.1°
O06C01H011108.2°109.7°
O06C01H012108.3°109.7°
C04C10H101120.5°120.2°
C16C21H211120.1°120.0°
H011C01H012109.5°109.7°
H021C02H022109.5°109.7°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C01C02O03H021121.1°119.7°
C01C02O03H022121.0°119.7°
C01C02O03C0410.2°46.5°
C02C01O06C0544.2°46.5°
C02C01O06H011120.7°119.7°
C02C01O06H012120.7°119.7°
C02C01H011H012117.8°120.6°
C01C02H021H022116.7°120.5°
C02O03C04C058.0°17.5°
O03C02C01O0637.0°60.2°
C02O03C04C10172.3°162.7°
O03C02C01H011157.7°59.5°
O03C02C01H01283.7°179.8°
O03C02H021H022116.7°120.7°
O03C04C05C10179.7°179.9°
O03C04C05O060.2°0.5°
O03C04C05C07180.0°179.7°
O03C04C10C09179.8°179.8°
O03C04C10H1010.2°0.5°
C04O03C02H021131.2°73.1°
C04O03C02H022110.9°166.2°
C04C05O06C07179.8°179.8°
C04C05C07C080.1°0.2°
C05C04C10C090.1°0.1°
C04C05O06C0127.4°17.4°
C05C04C10H101179.9°179.6°
C04C05C07H071179.8°179.9°
O06C05C07C08180.0°179.6°
O06C05C04C10179.9°179.6°
C05O06C01H011164.9°73.2°
C05O06C01H01276.6°166.2°
O06C05C07H0710.0°0.3°
C05C07C08H071180.0°179.9°
C05C07C08C090.2°0.1°
C07C05O06C01152.5°162.8°
C07C05C04C100.3°0.2°
C05C07C08C14179.6°179.9°
C07C08C09C14179.7°180.0°
C07C08C09C100.3°0.0°
C07C08C09N11180.0°179.8°
C07C08C14N13179.7°179.9°
C07C08C14N150.2°0.0°
C08C09C10N11179.6°179.8°
C08C09N11C120.3°0.3°
C09C08C14N130.0°0.1°
C09C08C14N15180.0°180.0°
C08C09C10C040.2°0.0°
C08C09C10H101179.8°179.7°
C09C08C07H071179.9°180.0°
C10C09N11C12179.3°180.0°
C09C10C04H101180.0°179.8°
C10C09C08C14179.4°180.0°
C09N11C12N130.0°0.0°
N11C09C10C04179.8°179.8°
N11C09C08C140.3°0.2°
N11C09C10H1010.2°0.0°
C09N11C12H121180.0°179.9°
N11C12N13H121180.0°179.9°
N11C12N13C140.3°0.3°
C12N13C14N15179.8°179.8°
C12N13C14C080.3°0.3°
N13C14N15C08179.9°179.9°
N13C14N15C160.8°6.4°
C14N13C12H121179.7°179.8°
N13C14N15H151179.2°173.5°
C14N15C16H151180.0°179.9°
C14N15C16C1758.9°161.2°
C14N15C16C21121.5°18.8°
N15C16C17C21179.7°180.0°
N15C16C21C20180.0°180.0°
N15C16C17C18179.6°180.0°
N15C16C17F230.2°0.3°
C16N15C14C08179.3°173.5°
N15C16C21H2110.0°0.0°
C17C16C21C200.3°0.0°
C16C17C18C190.6°0.0°
C16C17C18BR22179.1°180.0°
C16C17C18F23179.8°179.7°
C17C16C21H211179.7°179.9°
C17C16N15H151121.1°18.7°
C19C20C21H201180.0°180.0°
C20C19C18H191180.0°179.9°
C20C19C18BR22179.7°180.0°
C20C19C18C170.0°0.0°
C19C20C21C160.3°0.0°
C19C20C21H211179.7°179.9°
C21C20C19C180.4°0.0°
C20C21C16H211180.0°179.9°
C21C20C19H191179.6°179.9°
C19C18BR22C17179.7°180.0°
C19C18C17F23179.6°179.7°
C18C19C20H201179.6°180.0°
BR22C18C17F230.7°0.3°
BR22C18C19H1910.3°0.1°
C18C17C16C210.8°0.0°
C17C18C19H191180.0°180.0°
F23C17C16C21179.5°179.7°
O06C01H011H012117.8°120.6°
O06C01C02H021158.1°59.5°
O06C01C02H02284.0°179.9°
C14C08C07H0710.4°0.0°
C08C14N15H1510.7°6.6°
C16C21C20H201179.7°180.0°
C21C16N15H15158.5°161.3°
H201C20C21H2110.3°0.1°
H201C20C19H1910.4°0.1°
H011C01C02H02181.2°179.2°
H011C01C02H02236.7°60.2°
H012C01C02H02137.3°60.1°
H012C01C02H022155.2°60.4°

251174

PDB entries from 2026-03-25

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