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FB2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C01C02sing1.38Å1.40ÅAromatic
C01C06doub1.38Å1.40ÅAromatic
C02C03doub1.38Å1.41ÅAromatic
C03C04sing1.38Å1.42ÅAromatic
C04C05doub1.38Å1.41ÅAromatic
C04S07sing1.76Å1.64Å
C05C06sing1.38Å1.42ÅAromatic
S07O08doub1.42Å1.45Å
S07O09doub1.42Å1.43Å
S07NP0sing1.66Å1.59Å
C01H01sing1.08Å1.08Å
C02H02sing1.08Å1.08Å
C06H06sing1.08Å1.08Å
C03H03sing1.08Å1.08Å
C05H05sing1.08Å1.08Å
NP0HP01sing0.97Å1.00Å
NP0HP02sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C02C01C06118.2°120.0°
C01C02C03121.8°120.0°
C02C01H01120.9°120.0°
C01C02H02119.1°120.0°
C01C06C05119.6°120.0°
C06C01H01120.9°120.0°
C01C06H06120.2°120.0°
C02C03C04121.5°120.0°
C03C02H02119.1°120.0°
C02C03H03119.2°120.0°
C03C04C05115.3°120.0°
C03C04S07122.0°120.0°
C04C03H03119.2°120.0°
C05C04S07122.7°120.0°
C04C05C06123.6°120.0°
C04C05H05118.2°120.0°
C04S07O08107.2°106.4°
C04S07O09104.3°106.4°
C04S07NP0111.0°107.2°
C05C06H06120.2°120.0°
C06C05H05118.2°120.0°
O08S07O09115.6°123.1°
O08S07NP0109.6°106.4°
O09S07NP0109.0°106.4°
S07NP0HP01109.5°120.0°
S07NP0HP02109.4°120.0°
HP01NP0HP02109.4°119.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C02C01C06H01180.0°179.6°
C01C02C03H02180.0°179.9°
C01C02C03C040.4°0.1°
C02C01C06C050.2°0.0°
C02C01C06H06179.8°180.0°
C01C02C03H03179.6°179.9°
C06C01C02C030.3°0.1°
C01C06C05C040.1°0.1°
C01C06C05H06180.0°180.0°
C06C01C02H02179.7°180.0°
C01C06C05H05179.9°180.0°
C02C03C04H03180.0°180.0°
C02C03C04C050.2°0.0°
C02C03C04S07179.9°180.0°
C03C02C01H01179.7°179.7°
C03C04C05S07179.6°180.0°
C03C04C05C060.1°0.1°
C03C04S07O0814.9°23.5°
C03C04S07O09108.2°156.5°
C03C04S07NP0134.6°90.0°
C04C03C02H02179.6°180.0°
C03C04C05H05179.9°180.0°
C04C05C06H05180.0°179.9°
C05C04S07O08165.5°156.5°
C05C04S07O0971.4°23.5°
C05C04S07NP045.8°90.0°
C04C05C06H06179.9°179.9°
C05C04C03H03179.8°180.0°
S07C04C05C06179.7°179.9°
C04S07O08O09115.8°123.0°
C04S07O08NP0120.6°114.1°
C04S07O09NP0118.7°114.1°
S07C04C03H030.1°0.0°
S07C04C05H050.3°0.0°
C04S07NP0HP0131.2°0.0°
C04S07NP0HP0288.8°180.0°
C05C06C01H01179.8°179.6°
O08S07O09NP0123.9°122.9°
O08S07NP0HP0187.0°113.5°
O08S07NP0HP02153.0°66.4°
O09S07NP0HP01145.5°113.6°
O09S07NP0HP0225.6°66.4°
S07NP0HP01HP02120.0°180.0°
H01C01C02H020.3°0.3°
H01C01C06H060.2°0.3°
H02C02C03H030.4°0.0°
H06C06C05H050.1°0.1°

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PDB entries from 2024-07-24

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