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SummaryGeometryPCM/PTMRelated PDB entries

A1LX2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C24C23doub1.39Å1.38ÅAromatic
C24C25sing1.39Å1.39ÅAromatic
C23N22sing1.31Å1.32ÅAromatic
F13C10sing1.40Å1.38Å
N22C21doub1.33Å1.32ÅAromatic
C25C26doub1.39Å1.40ÅAromatic
C08C07doub1.38Å1.39ÅAromatic
C08C09sing1.38Å1.39ÅAromatic
C07C06sing1.39Å1.38ÅAromatic
F12C10sing1.40Å1.37Å
C10C09sing1.51Å1.54Å
C10F11sing1.40Å1.37Å
O30C17doub1.22Å1.19Å
C21C26sing1.40Å1.39ÅAromatic
C21C20sing1.48Å1.54Å
C09C14doub1.38Å1.38ÅAromatic
C19C20sing1.51Å1.54Å
C19N18sing1.46Å1.46Å
C17N18sing1.35Å1.46Å
C17N05sing1.34Å1.48Å
C06N05sing1.40Å1.45Å
C06C16doub1.39Å1.38ÅAromatic
C20O27doub1.21Å1.19Å
N18C28sing1.35Å1.45Å
N05N04sing1.28Å1.42Å
C14C16sing1.38Å1.38ÅAromatic
C14F15sing1.35Å1.36Å
C28O29doub1.22Å1.19Å
C28C03sing1.48Å1.50Å
N04C03doub1.32Å1.44Å
C03C02sing1.47Å1.53Å
N01C02doub1.29Å1.25Å
C24H1sing1.08Å1.08Å
C26H2sing1.08Å1.08Å
C02H3sing1.08Å1.08Å
C07H4sing1.08Å1.08Å
C08H5sing1.08Å1.08Å
C16H6sing1.08Å1.08Å
C19H7sing1.09Å1.10Å
C19H8sing1.09Å1.10Å
C23H9sing1.08Å1.08Å
C25H10sing1.08Å1.08Å
N01H11sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C23C24C25118.3°119.4°
C24C23N22120.9°121.0°
C23C24H1120.8°120.3°
C24C23H9119.5°119.5°
C24C25C26119.2°118.5°
C25C24H1120.8°120.3°
C24C25H10120.4°120.7°
C23N22C21122.8°121.6°
N22C23H9119.5°119.5°
F13C10F12111.2°109.5°
F13C10C09111.5°109.5°
F13C10F11108.9°109.5°
N22C21C26119.6°120.5°
N22C21C20119.8°119.7°
C25C26C21119.1°119.1°
C25C26H2120.5°120.5°
C26C25H10120.4°120.8°
C07C08C09120.4°120.1°
C08C07C06119.9°120.0°
C08C07H4120.0°120.0°
C07C08H5119.8°119.9°
C08C09C10122.6°120.0°
C08C09C14118.8°120.1°
C09C08H5119.8°119.9°
C07C06N05122.4°120.1°
C07C06C16120.0°119.8°
C06C07H4120.1°120.0°
F12C10C09108.6°109.5°
F12C10F11106.8°109.4°
C09C10F11109.7°109.5°
C10C09C14118.7°119.9°
O30C17N18119.6°119.4°
O30C17N05121.2°119.3°
C26C21C20120.6°119.8°
C21C26H2120.4°120.5°
C21C20C19119.9°120.0°
C21C20O27119.4°120.0°
C09C14C16121.1°120.0°
C09C14F15119.3°120.0°
C20C19N18112.1°109.5°
C19C20O27120.7°120.0°
C20C19H7108.8°109.4°
C20C19H8108.8°109.5°
C19N18C17118.4°120.7°
C19N18C28121.2°120.7°
N18C19H7108.8°109.5°
N18C19H8108.8°109.5°
N18C17N05119.2°121.3°
C17N18C28120.4°118.6°
C17N05C06124.5°118.7°
C17N05N04120.3°122.7°
N05C06C16117.6°120.1°
C06N05N04115.2°118.7°
C06C16C14119.8°120.0°
C06C16H6120.1°120.0°
N18C28O29121.4°121.1°
N18C28C03119.4°117.7°
N05N04C03121.5°121.1°
C16C14F15119.6°120.0°
C14C16H6120.1°120.0°
O29C28C03119.2°121.2°
C28C03N04119.3°118.7°
C28C03C02123.0°120.7°
N04C03C02117.6°120.7°
C03C02N01120.1°120.0°
C03C02H3119.9°120.0°
N01C02H3120.0°120.0°
C02N01H11112.0°120.0°
H7C19H8109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C23C24C25H1180.0°179.3°
C24C23N22H9180.0°179.2°
C24C23N22C210.5°0.6°
C23C24C25C260.6°0.5°
C23C24C25H10179.4°179.4°
C25C24C23N220.7°0.8°
C24C25C26H10180.0°179.9°
C24C25C26C210.4°0.0°
C24C25C26H2179.6°180.0°
C25C24C23H9179.4°179.9°
C23N22C21C260.3°0.1°
C23N22C21C20179.8°179.7°
N22C23C24H1179.3°180.0°
F13C10C09C0812.2°120.0°
F13C10F12C09123.0°120.0°
F13C10F12F11118.7°120.0°
F13C10C09F11120.7°120.0°
F13C10C09C14167.1°60.0°
N22C21C26C250.2°0.2°
N22C21C26C20180.0°179.8°
N22C21C20C1925.2°0.2°
N22C21C20O27153.8°179.8°
N22C21C26H2179.8°179.8°
C21N22C23H9179.5°179.8°
C25C26C21H2180.0°180.0°
C25C26C21C20179.9°180.0°
C26C25C24H1179.4°179.7°
C07C08C09H5180.0°180.0°
C08C07C06H4180.0°179.9°
C07C08C09C10179.2°180.0°
C07C08C09C140.1°0.0°
C08C07C06N05179.5°180.0°
C08C07C06C160.6°0.3°
C09C08C07C060.6°0.0°
C08C09C10F12110.7°120.0°
C08C09C10C14179.3°179.9°
C08C09C10F11132.9°0.0°
C08C09C14C160.5°0.3°
C08C09C14F15178.8°180.0°
C09C08C07H4179.4°180.0°
C07C06N05C1760.0°49.4°
C07C06N05C16179.0°179.7°
C07C06N05N04121.1°130.6°
C07C06C16C140.1°0.6°
C06C07C08H5179.4°180.0°
C07C06C16H6179.9°179.7°
F12C10C09F11116.4°119.9°
F12C10C09C1470.0°60.1°
C10C09C14C16179.8°179.7°
C10C09C14F150.5°0.0°
C10C09C08H50.8°0.0°
F11C10C09C1446.4°180.0°
O30C17N18C190.5°0.2°
O30C17N18N05179.7°179.7°
O30C17N05C060.4°0.3°
O30C17N18C28179.9°179.7°
O30C17N05N04179.3°179.7°
C26C21C20C19154.7°180.0°
C26C21C20O2726.2°0.1°
C21C26C25H10179.6°179.9°
C21C20C19O27179.0°179.9°
C21C20C19N18150.4°180.0°
C20C21C26H20.1°0.1°
C21C20C19H730.0°60.0°
C21C20C19H889.2°59.9°
C09C14C16C060.5°0.6°
C09C14C16F15179.3°179.7°
C14C09C08H5179.9°180.0°
C09C14C16H6179.5°179.7°
C20C19N18H7120.4°120.0°
C20C19N18H8120.4°120.0°
C20C19N18C1778.0°90.0°
C20C19N18C28102.5°90.1°
C20C19H7H8118.8°119.9°
C19N18C17C28179.6°180.0°
C19N18C17N05179.7°180.0°
N18C19C20O2730.5°0.0°
C19N18C28O290.0°0.0°
C19N18C28C03179.9°180.0°
N18C19H7H8118.8°120.1°
N18C17N05C06179.3°180.0°
N18C17N05N040.5°0.0°
C17N18C28O29179.6°180.0°
C17N18C28C030.5°0.0°
C17N18C19H742.4°30.0°
C17N18C19H8161.6°150.0°
C17N05C06N04178.9°180.0°
C17N05C06C16121.1°130.9°
N05C17N18C280.1°0.0°
C17N05N04C030.6°0.0°
N05C06C16C14179.0°179.7°
C06N05N04C03179.6°180.0°
N05C06C07H40.5°0.1°
N05C06C16H60.9°0.0°
C16C06N05N0457.9°49.1°
C06C16C14H6180.0°179.7°
C06C16C14F15178.8°179.7°
C16C06C07H4179.4°179.8°
O27C20C19H7151.0°120.0°
O27C20C19H889.9°120.0°
N18C28O29C03179.9°180.0°
N18C28C03N040.4°0.0°
N18C28C03C02179.4°180.0°
C28N18C19H7137.2°150.0°
C28N18C19H817.9°30.0°
N05N04C03C280.2°0.0°
N05N04C03C02180.0°180.0°
F15C14C16H61.2°0.0°
O29C28C03N04179.8°180.0°
O29C28C03C020.5°0.0°
C28C03N04C02179.7°180.0°
C28C03C02N0183.5°180.0°
C28C03C02H396.5°0.0°
N04C03C02N0196.8°0.0°
N04C03C02H383.2°180.0°
C03C02N01H3180.0°180.0°
C03C02N01H11180.0°180.0°
H1C24C23H90.7°0.8°
H1C24C25H100.6°0.2°
H2C26C25H100.4°0.1°
H3C02N01H110.0°0.1°
H4C07C08H50.6°0.0°

251801

PDB entries from 2026-04-08

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