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EFX

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O1Cdoub1.21Å1.25Å
C10C11doub1.38Å1.38ÅAromatic
C10C9sing1.38Å1.38ÅAromatic
C11C4sing1.39Å1.39ÅAromatic
CC1sing1.48Å1.51Å
COsing1.35Å1.26Å
C9C6doub1.40Å1.39ÅAromatic
C14C1doub1.40Å1.39ÅAromatic
C14C13sing1.38Å1.38ÅAromatic
C1C2sing1.39Å1.39ÅAromatic
C13C12doub1.38Å1.38ÅAromatic
C2C3doub1.39Å1.40ÅAromatic
C3C4sing1.48Å1.49Å
C3C12sing1.39Å1.40ÅAromatic
C4C5doub1.39Å1.40ÅAromatic
C6C5sing1.40Å1.39ÅAromatic
C6C7sing1.48Å1.49Å
O3C7doub1.22Å1.21Å
C7O2sing1.35Å1.33Å
O2C8sing1.45Å1.45Å
OH11sing0.97Å0.95Å
C10H6sing1.08Å1.08Å
C11H7sing1.08Å1.08Å
C12H8sing1.08Å1.08Å
C13H9sing1.08Å1.08Å
C14H10sing1.08Å1.08Å
C2Hsing1.08Å1.08Å
C5H1sing1.08Å1.08Å
C8H3sing1.09Å1.10Å
C8H4sing1.09Å1.10Å
C8H2sing1.09Å1.10Å
C9H5sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1CC1117.8°120.0°
O1CO124.6°120.0°
C11C10C9120.2°120.3°
C10C11C4120.7°120.2°
C11C10H6119.9°119.8°
C10C11H7119.6°120.0°
C10C9C6120.2°120.1°
C9C10H6119.9°119.9°
C10C9H5119.9°119.9°
C11C4C3121.1°120.1°
C11C4C5118.3°119.9°
C4C11H7119.7°119.9°
C1CO117.6°120.0°
CC1C14120.7°120.1°
CC1C2120.0°120.0°
COH11109.5°117.0°
C9C6C5119.2°119.8°
C9C6C7120.9°120.1°
C6C9H5119.9°119.9°
C1C14C13120.2°120.1°
C14C1C2119.3°119.9°
C1C14H10119.9°120.0°
C14C13C12120.2°120.3°
C14C13H9119.9°119.8°
C13C14H10119.9°120.0°
C1C2C3121.2°119.7°
C1C2H119.4°120.2°
C13C12C3120.8°120.2°
C13C12H8119.6°119.9°
C12C13H9119.9°119.9°
C2C3C4120.3°120.0°
C2C3C12118.3°119.9°
C3C2H119.4°120.2°
C4C3C12121.2°120.1°
C3C4C5120.5°120.0°
C3C12H8119.6°119.9°
C4C5C6120.9°119.7°
C4C5H1119.5°120.2°
C5C6C7120.0°120.0°
C6C5H1119.5°120.1°
C6C7O3124.4°120.1°
C6C7O2112.3°120.0°
O3C7O2123.3°119.9°
C7O2C8116.0°117.0°
O2C8H3109.5°109.4°
O2C8H4109.4°109.5°
O2C8H2109.5°109.5°
H3C8H4109.5°109.5°
H3C8H2109.5°109.5°
H4C8H2109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1CC1O179.4°179.8°
O1CC1C1414.5°179.4°
O1CC1C2164.1°0.2°
O1COH110.0°0.2°
C11C10C9H6180.0°179.8°
C10C11C4H7180.0°180.0°
C11C10C9C62.2°0.0°
C10C11C4C3170.3°180.0°
C10C11C4C54.6°0.0°
C11C10C9H5177.8°180.0°
C9C10C11C40.9°0.0°
C10C9C6H5180.0°180.0°
C10C9C6C52.1°0.0°
C10C9C6C7179.1°180.0°
C9C10C11H7179.1°179.9°
C11C4C3C2148.1°0.1°
C11C4C3C5174.8°180.0°
C11C4C3C1227.7°180.0°
C11C4C5C69.0°0.0°
C4C11C10H6179.1°179.8°
C11C4C5H1171.0°179.9°
CC1C14C2178.6°179.7°
CC1C14C13178.6°180.0°
CC1C2C3177.3°180.0°
C1COH11179.4°180.0°
CC1C14H101.4°0.1°
CC1C2H2.8°0.0°
OCC1C14166.1°0.3°
OCC1C215.3°180.0°
C9C6C5C47.8°0.0°
C9C6C5C7178.8°179.9°
C9C6C7O31.6°180.0°
C9C6C7O2178.8°0.0°
C6C9C10H6177.8°179.8°
C9C6C5H1172.2°180.0°
C1C14C13H10180.0°179.9°
C1C14C13C120.6°0.1°
C14C1C2C31.4°0.3°
C1C14C13H9179.4°180.0°
C14C1C2H178.6°179.7°
C13C14C1C20.0°0.3°
C14C13C12H9180.0°179.9°
C14C13C12C30.1°0.1°
C14C13C12H8179.9°180.0°
C1C2C3H180.0°180.0°
C1C2C3C4173.8°180.0°
C1C2C3C122.1°0.1°
C2C1C14H10180.0°179.8°
C13C12C3C21.4°0.1°
C13C12C3C4174.4°179.8°
C13C12C3H8180.0°179.8°
C12C13C14H10179.4°180.0°
C2C3C4C12175.8°179.9°
C2C3C4C526.7°180.0°
C2C3C12H8178.5°180.0°
C3C4C5C6165.9°180.0°
C3C4C11H79.7°0.0°
C4C3C12H85.6°0.0°
C4C3C2H6.2°0.0°
C3C4C5H114.1°0.0°
C12C3C4C5157.5°0.0°
C3C12C13H9179.8°179.8°
C12C3C2H177.9°179.9°
C4C5C6H1180.0°179.9°
C4C5C6C7173.4°180.0°
C5C4C11H7175.4°179.9°
C5C6C7O3179.6°0.0°
C5C6C7O20.0°180.0°
C5C6C9H5177.8°179.9°
C6C7O3O2179.5°180.0°
C6C7O2C8177.0°180.0°
C7C6C5H16.6°0.1°
C7C6C9H51.0°0.0°
O3C7O2C82.6°0.0°
C7O2C8H3180.0°60.0°
C7O2C8H460.0°60.0°
C7O2C8H260.0°180.0°
O2C8H3H4120.0°120.0°
O2C8H3H2120.0°120.0°
O2C8H4H2120.0°120.0°
H6C10C11H70.9°0.3°
H6C10C9H52.2°0.2°
H8C12C13H90.2°0.1°
H9C13C14H100.6°0.1°
H3C8H4H2120.0°120.0°

225681

PDB entries from 2024-10-02

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