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Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.53Å1.48Å
C1F1sing1.40Å1.36Å
C1F2sing1.40Å1.33Å
C1F3sing1.40Å1.33Å
C2Osing1.43Å1.43Å
C2H21sing1.09Å1.11Å
C2H22sing1.09Å1.12Å
OHOsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1F1113.1°109.4°
C2C1F2108.4°109.5°
C2C1F3112.4°109.5°
C1C2O106.7°109.5°
C1C2H21113.3°109.5°
C1C2H22113.2°109.5°
F1C1F2108.6°109.5°
F1C1F3104.5°109.5°
F2C1F3109.8°109.5°
OC2H21113.3°109.4°
OC2H22113.3°109.5°
C2OHO106.6°106.8°
H21C2H2297.2°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1F1F2120.4°120.0°
C2C1F1F3122.5°120.0°
C2C1F2F3123.1°120.0°
C1C2OH21125.3°120.0°
C1C2OH22125.2°120.0°
C1C2H21H22119.2°120.0°
C1C2OHO179.9°179.9°
F1C1F2F3113.7°120.1°
F1C1C2O175.0°180.0°
F1C1C2H2149.7°60.0°
F1C1C2H2259.7°60.0°
F2C1C2O54.6°60.0°
F2C1C2H2170.8°180.0°
F2C1C2H22179.8°60.0°
F3C1C2O66.9°60.0°
F3C1C2H21167.7°59.9°
F3C1C2H2258.3°180.0°
OC2H21H22119.2°120.0°
H21C2OHO54.8°60.1°
H22C2OHO54.7°59.9°

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PDB entries from 2024-07-17

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