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SummaryGeometryRelated PDB entries

A1CEI

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
N11N12sing1.41Å1.27ÅAromatic
N11N10doub1.29Å1.38ÅAromatic
N12C08sing1.36Å1.42ÅAromatic
N10N09sing1.28Å1.34ÅAromatic
C08N09doub1.32Å1.36ÅAromatic
C08C05sing1.48Å1.42Å
C06C05doub1.39Å1.39ÅAromatic
C06C07sing1.38Å1.37ÅAromatic
C05C04sing1.39Å1.40ÅAromatic
C07C02doub1.38Å1.37ÅAromatic
C04C03doub1.38Å1.38ÅAromatic
C02C03sing1.38Å1.38ÅAromatic
C02BR1sing1.89Å1.82Å
N12H1sing0.97Å1.00Å
C03H2sing1.08Å1.08Å
C04H3sing1.08Å1.08Å
C06H4sing1.08Å1.08Å
C07H5sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
N12N11N10107.7°106.9°
N11N12C08107.0°105.2°
N11N12H1126.5°127.4°
N11N10N09112.5°110.4°
N12C08N09110.1°107.0°
N12C08C05123.7°126.5°
C08N12H1126.5°127.4°
N10N09C08102.8°110.5°
N09C08C05126.1°126.5°
C08C05C06118.3°120.1°
C08C05C04119.1°120.1°
C05C06C07119.0°119.9°
C06C05C04122.6°119.8°
C05C06H4120.5°120.1°
C06C07C02117.6°120.1°
C07C06H4120.5°120.0°
C06C07H5121.2°119.9°
C05C04C03118.4°119.9°
C05C04H3120.8°120.0°
C07C02C03125.0°120.3°
C07C02BR1117.4°119.9°
C02C07H5121.2°119.9°
C04C03C02117.5°120.1°
C04C03H2121.3°120.0°
C03C04H3120.8°120.1°
C03C02BR1117.6°119.9°
C02C03H2121.3°119.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
N11N12C08H1180.0°179.7°
N12N11N10N090.3°0.5°
N11N12C08N090.5°0.2°
N11N12C08C05179.6°179.7°
N10N11N12C080.4°0.4°
N11N10N09C080.1°0.4°
N10N11N12H1179.5°179.8°
N12C08N09N100.3°0.1°
N12C08N09C05179.1°179.9°
N12C08C05C066.1°0.0°
N12C08C05C04174.7°180.0°
N10N09C08C05179.4°180.0°
N09C08C05C06172.9°179.9°
N09C08C05C046.3°0.1°
N09C08N12H1179.5°180.0°
C08C05C06C04179.2°180.0°
C08C05C06C07179.6°179.8°
C08C05C04C03179.9°180.0°
C05C08N12H10.4°0.1°
C08C05C04H30.2°0.1°
C08C05C06H40.4°0.0°
C05C06C07H4180.0°179.7°
C05C06C07C020.1°0.5°
C06C05C04C030.7°0.0°
C06C05C04H3179.3°180.0°
C05C06C07H5179.9°180.0°
C07C06C05C040.5°0.2°
C06C07C02H5180.0°179.5°
C06C07C02C030.5°0.5°
C06C07C02BR1179.5°179.7°
C05C04C03H3180.0°179.9°
C05C04C03C020.3°0.0°
C05C04C03H2179.7°180.0°
C04C05C06H4179.6°180.0°
C07C02C03C040.3°0.2°
C07C02C03BR1180.0°179.8°
C07C02C03H2179.7°179.7°
C02C07C06H4179.8°179.7°
C04C03C02H2180.0°180.0°
C04C03C02BR1179.7°180.0°
C02C03C04H3179.7°180.0°
C03C02C07H5179.5°180.0°
BR1C02C03H20.3°0.0°
BR1C02C07H50.5°0.2°
H2C03C04H30.3°0.1°
H4C06C07H50.2°0.2°

250835

PDB entries from 2026-03-18

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