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JB5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C07N06doub1.31Å1.36ÅAromatic
C07C08sing1.40Å1.40ÅAromatic
N06C05sing1.34Å1.38ÅAromatic
C08N09doub1.31Å1.35ÅAromatic
C05C04sing1.41Å1.43ÅAromatic
C05C10doub1.42Å1.36ÅAromatic
N09C10sing1.34Å1.39ÅAromatic
C04C03doub1.36Å1.39ÅAromatic
C10C11sing1.40Å1.43ÅAromatic
C03C02sing1.40Å1.39ÅAromatic
C11C02doub1.38Å1.40ÅAromatic
C02N01sing1.39Å1.42Å
N01H1sing0.97Å1.00Å
N01H2sing0.97Å1.00Å
C03H3sing1.08Å1.08Å
C04H4sing1.08Å1.08Å
C07H5sing1.08Å1.08Å
C08H6sing1.08Å1.08Å
C11H7sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
N06C07C08120.0°120.7°
C07N06C05119.7°119.8°
N06C07H5120.0°119.7°
C07C08N09120.0°120.7°
C08C07H5120.0°119.6°
C07C08H6120.0°119.7°
N06C05C04119.3°120.9°
N06C05C10120.5°119.6°
C08N09C10119.9°119.7°
N09C08H6120.0°119.7°
C04C05C10120.2°119.5°
C05C04C03120.3°119.9°
C05C04H4119.8°120.1°
C05C10N09119.9°119.6°
C05C10C11119.5°119.4°
N09C10C11120.6°121.0°
C04C03C02119.8°120.9°
C04C03H3120.1°119.5°
C03C04H4119.9°120.0°
C10C11C02120.1°119.6°
C10C11H7120.0°120.2°
C03C02C11120.2°120.6°
C03C02N01119.0°119.7°
C02C03H3120.1°119.5°
C11C02N01120.8°119.7°
C02C11H7120.0°120.2°
C02N01H1109.5°120.0°
C02N01H2109.5°120.0°
H1N01H2109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N06C07C08H5180.0°179.9°
N06C07C08N090.2°0.3°
C07N06C05C04179.9°180.0°
C07N06C05C100.2°0.0°
N06C07C08H6179.9°180.0°
C08C07N06C050.1°0.0°
C07C08N09H6180.0°179.6°
C07C08N09C100.0°0.6°
N06C05C04C10179.9°180.0°
N06C05C10N090.3°0.3°
N06C05C04C03179.7°180.0°
N06C05C10C11180.0°180.0°
N06C05C04H40.3°0.0°
C05N06C07H5179.9°179.9°
C08N09C10C050.3°0.6°
C08N09C10C11180.0°179.7°
N09C08C07H5179.9°179.6°
C04C05C10N09179.8°179.7°
C05C04C03H4180.0°179.9°
C04C05C10C110.1°0.0°
C05C04C03C020.1°0.1°
C05C04C03H3179.9°180.0°
C05C10N09C11179.7°179.7°
C10C05C04C030.2°0.0°
C05C10C11C020.3°0.0°
C10C05C04H4179.8°180.0°
C05C10C11H7179.6°180.0°
N09C10C11C02180.0°179.7°
C10N09C08H6179.9°179.8°
N09C10C11H70.1°0.3°
C04C03C02H3180.0°179.9°
C04C03C02C110.2°0.1°
C04C03C02N01179.2°180.0°
C10C11C02C030.4°0.0°
C10C11C02H7180.0°180.0°
C10C11C02N01179.0°180.0°
C03C02C11N01179.4°180.0°
C03C02N01H1180.0°0.0°
C03C02N01H260.0°179.9°
C02C03C04H4179.9°180.0°
C03C02C11H7179.6°179.9°
C11C02N01H10.6°180.0°
C11C02N01H2119.4°0.0°
C11C02C03H3179.8°180.0°
C02N01H1H2120.0°179.9°
N01C02C03H30.8°0.1°
N01C02C11H71.0°0.0°
H3C03C04H40.1°0.1°
H5C07C08H60.1°0.0°

223166

PDB entries from 2024-07-31

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