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SummaryGeometryRelated PDB entries

A1CLE

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C01C02doub1.38Å1.39ÅAromatic
C01C06sing1.39Å1.41ÅAromatic
C02C03sing1.40Å1.40ÅAromatic
C03C04doub1.40Å1.40ÅAromatic
C03C07sing1.47Å1.45Å
C04C05sing1.39Å1.39ÅAromatic
C04O02sing1.35Å1.36Å
C05C06doub1.38Å1.39ÅAromatic
C07C09sing1.52Å1.52Å
C07O01doub1.21Å1.20Å
O02C08sing1.43Å1.47Å
C08C09sing1.53Å1.55Å
C08C10sing1.53Å1.54Å
C08C14sing1.53Å1.54Å
C10C11sing1.53Å1.54Å
C11N01sing1.47Å1.48Å
N01C13sing1.47Å1.49Å
N01C12sing1.47Å1.48Å
C13C14sing1.53Å1.55Å
C10H07sing1.09Å1.10Å
C10H08sing1.09Å1.10Å
C13H14sing1.09Å1.10Å
C13H15sing1.09Å1.10Å
C01H01sing1.08Å1.08Å
C02H02sing1.08Å1.08Å
C05H03sing1.08Å1.08Å
C06H04sing1.08Å1.08Å
C09H05sing1.09Å1.10Å
C09H06sing1.09Å1.10Å
C11H09sing1.09Å1.10Å
C11H10sing1.09Å1.10Å
C12H11sing1.09Å1.10Å
C12H12sing1.09Å1.10Å
C12H13sing1.09Å1.10Å
C14H16sing1.09Å1.10Å
C14H17sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C02C01C06121.7°120.2°
C01C02C03119.4°119.7°
C02C01H01119.1°119.9°
C01C02H02120.3°120.2°
C01C06C05118.8°120.7°
C06C01H01119.2°119.9°
C01C06H04120.6°119.6°
C02C03C04118.4°120.2°
C02C03C07122.0°120.8°
C03C02H02120.3°120.2°
C04C03C07119.6°119.1°
C03C04C05122.2°119.3°
C03C04O02119.8°120.8°
C03C07C09121.9°116.6°
C03C07O01120.5°121.7°
C05C04O02118.0°120.0°
C04C05C06119.5°120.1°
C04C05H03120.2°120.0°
C04O02C08122.9°118.8°
C06C05H03120.3°120.0°
C05C06H04120.6°119.7°
C09C07O01117.6°121.7°
C07C09C08110.5°107.2°
C07C09H05109.2°109.9°
C07C09H06109.2°109.9°
O02C08C09112.8°109.5°
O02C08C10106.2°109.6°
O02C08C14109.2°109.7°
C09C08C10108.7°109.3°
C09C08C14109.3°109.4°
C08C09H05109.2°109.9°
C08C09H06109.2°109.9°
C10C08C14110.6°109.3°
C08C10C11106.1°109.2°
C08C10H07110.3°109.5°
C08C10H08110.3°109.6°
C08C14C13107.3°109.3°
C08C14H16110.0°109.5°
C08C14H17110.0°109.5°
C10C11N01106.5°109.5°
C11C10H07110.3°109.6°
C11C10H08110.3°109.5°
C10C11H09110.2°109.4°
C10C11H10110.2°109.5°
C11N01C13115.1°111.2°
C11N01C12115.4°111.0°
N01C11H09110.2°109.4°
N01C11H10110.2°109.5°
C13N01C12115.2°111.0°
N01C13C14111.9°109.5°
N01C13H14108.8°109.5°
N01C13H15108.8°109.5°
N01C12H11109.5°109.5°
N01C12H12109.4°109.5°
N01C12H13109.5°109.4°
C14C13H14108.9°109.4°
C14C13H15108.8°109.5°
C13C14H16110.0°109.5°
C13C14H17110.0°109.5°
H07C10H08109.5°109.5°
H14C13H15109.5°109.5°
H05C09H06109.5°110.0°
H09C11H10109.5°109.5°
H11C12H12109.5°109.5°
H11C12H13109.5°109.5°
H12C12H13109.5°109.5°
H16C14H17109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C02C01C06H01180.0°179.9°
C01C02C03H02180.0°180.0°
C01C02C03C040.6°0.4°
C01C02C03C07179.0°179.3°
C02C01C06C051.2°0.2°
C02C01C06H04178.7°179.8°
C06C01C02C030.5°0.0°
C01C06C05C040.8°0.0°
C01C06C05H04180.0°180.0°
C06C01C02H02179.5°179.9°
C01C06C05H03179.2°180.0°
C02C03C04C07178.5°179.7°
C02C03C04C051.0°0.6°
C02C03C04O02179.7°179.1°
C02C03C07C09175.6°168.0°
C02C03C07O013.4°11.9°
C03C02C01H01179.5°179.9°
C03C04C05O02179.3°179.7°
C03C04C05C060.3°0.4°
C04C03C07C092.8°12.2°
C04C03C07O01178.2°167.8°
C03C04O02C0818.3°22.8°
C04C03C02H02179.4°179.6°
C03C04C05H03179.7°179.6°
C07C03C04C05179.4°179.1°
C07C03C04O021.2°1.2°
C03C07C09O01179.0°180.0°
C03C07C09C0822.7°39.8°
C07C03C02H021.0°0.6°
C03C07C09H0597.4°159.2°
C03C07C09H06142.9°79.6°
C04C05C06H03180.0°180.0°
C05C04O02C08161.1°157.5°
C04C05C06H04179.1°180.0°
O02C04C05C06179.6°179.3°
C04O02C08C0938.9°52.6°
C04O02C08C1080.0°172.5°
C04O02C08C14160.7°67.5°
O02C04C05H030.4°0.7°
C05C06C01H01178.8°179.9°
C07C09C08O0237.9°58.4°
C07C09C08H05120.1°119.4°
C07C09C08H06120.2°119.5°
C07C09C08C1079.6°178.5°
C07C09C08C14159.6°61.9°
C07C09H05H06119.5°121.1°
O01C07C09C08158.3°140.2°
O01C07C09H0581.6°20.8°
O01C07C09H0638.1°100.3°
O02C08C09C10117.5°120.1°
O02C08C09C14121.7°120.3°
O02C08C10C14118.3°120.3°
O02C08C10C1151.6°62.6°
O02C08C14C1357.7°62.7°
O02C08C10H07171.1°177.4°
O02C08C10H0867.9°57.3°
O02C08C09H0582.2°177.7°
O02C08C09H06158.1°61.1°
O02C08C14H1661.9°177.4°
O02C08C14H17177.4°57.3°
C09C08C10C14120.0°119.7°
C09C08C10C11173.3°177.3°
C09C08C14C13178.4°177.2°
C09C08C10H0767.2°57.4°
C09C08C10H0853.8°62.7°
C08C09H05H06119.5°121.1°
C09C08C14H1662.0°57.3°
C09C08C14H1758.7°62.8°
C08C10C11H07119.5°119.9°
C08C10C11H08119.5°120.0°
C08C10C11N0163.9°59.2°
C10C08C14C1358.7°57.6°
C08C10H07H08121.5°120.2°
C10C08C09H05160.3°62.2°
C10C08C09H0640.6°59.0°
C08C10C11H09176.6°179.1°
C08C10C11H1055.6°60.9°
C10C08C14H16178.4°62.4°
C10C08C14H1760.9°177.5°
C14C08C10C1166.7°57.6°
C08C14C13N0150.8°59.0°
C08C14C13H16119.6°120.0°
C08C14C13H17119.7°120.0°
C14C08C10H0752.8°62.3°
C14C08C10H08173.8°177.6°
C08C14C13H14171.1°61.0°
C08C14C13H1569.6°179.0°
C14C08C09H0539.5°57.5°
C14C08C09H0680.2°178.6°
C08C14H16H17121.0°120.1°
C10C11N01H09119.5°119.9°
C10C11N01H10119.6°120.1°
C10C11N01C1360.6°61.8°
C10C11N01C12161.5°174.1°
C11C10H07H08121.6°120.1°
C10C11H09H10121.4°120.0°
C11N01C13C12138.1°124.1°
C11N01C13C1454.9°61.7°
N01C11C10H0755.6°60.7°
N01C11C10H08176.7°179.2°
C11N01C13H14175.3°58.3°
C11N01C13H1565.5°178.3°
N01C11H09H10121.3°120.0°
C11N01C12H11180.0°60.0°
C11N01C12H1260.0°179.9°
C11N01C12H1360.0°60.0°
N01C13C14H14120.4°120.0°
N01C13C14H15120.4°120.0°
N01C13H14H15118.9°120.0°
C13N01C11H09179.9°178.2°
C13N01C11H1059.0°58.2°
C13N01C12H1142.1°64.3°
C13N01C12H12162.1°55.7°
C13N01C12H1377.9°175.8°
N01C13C14H16170.4°61.0°
N01C13C14H1768.9°179.0°
C12N01C13C14167.0°174.2°
C12N01C13H1446.7°65.8°
C12N01C13H1572.6°54.2°
C12N01C11H0941.9°54.2°
C12N01C11H1079.0°65.9°
N01C12H11H12120.0°120.0°
N01C12H11H13120.0°120.0°
N01C12H12H13120.0°120.0°
C14C13H14H15118.9°120.0°
C13C14H16H17121.0°120.1°
H07C10C11H0963.9°59.2°
H07C10C11H10175.1°179.2°
H08C10C11H0957.1°60.9°
H08C10C11H1063.8°59.1°
H14C13C14H1669.3°179.0°
H14C13C14H1751.4°59.0°
H15C13C14H1650.0°59.1°
H15C13C14H17170.7°61.0°
H01C01C02H020.5°0.0°
H01C01C06H041.3°0.1°
H03C05C06H040.8°0.0°
H11C12H12H13120.0°120.0°

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PDB entries from 2026-08-26

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