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Obsolete: PNL

PNL was replaced with CBG on
Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1O1doub1.21Å1.23Å
C1C2sing1.51Å1.53Å
C1H1sing1.08Å1.10Å
C2C3sing1.53Å1.52Å
C2H21sing1.09Å1.11Å
C2H22sing1.09Å1.11Å
C3H31sing1.09Å1.11Å
C3H32sing1.09Å1.11Å
C3H33sing1.09Å1.12Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1C1C2121.2°120.0°
O1C1H1108.6°120.0°
C2C1H1130.2°120.0°
C1C2C3113.5°109.5°
C1C2H21110.7°109.5°
C1C2H22110.7°109.5°
C3C2H21110.8°109.5°
C3C2H22110.7°109.4°
C2C3H31113.5°109.5°
C2C3H32110.7°109.4°
C2C3H33110.7°109.5°
H21C2H2299.6°109.4°
H31C3H32110.8°109.5°
H31C3H33110.7°109.5°
H32C3H3399.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1C1C2H1180.0°180.0°
O1C1C2C312.8°120.1°
O1C1C2H21112.5°0.0°
O1C1C2H22138.1°120.0°
C1C2C3H21125.2°120.1°
C1C2C3H22125.3°120.0°
C1C2H21H22116.6°120.0°
C1C2C3H31180.0°180.0°
C1C2C3H3254.7°60.0°
C1C2C3H3354.7°60.0°
H1C1C2C3167.2°60.0°
H1C1C2H2167.5°180.0°
H1C1C2H2242.0°60.0°
C3C2H21H22116.6°119.9°
C2C3H31H32125.3°120.0°
C2C3H31H33125.2°120.0°
C2C3H32H33116.6°120.0°
H21C2C3H3154.7°59.9°
H21C2C3H32179.9°60.1°
H21C2C3H3370.5°180.0°
H22C2C3H3154.8°60.0°
H22C2C3H3270.6°180.0°
H22C2C3H33180.0°60.0°
H31C3H32H33116.6°120.0°

226262

PDB entries from 2024-10-16

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