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SummaryGeometryRelated PDB entries

3R6

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
O12C10doub1.22Å1.26Å
O11C10sing1.35Å1.26Å
C10C08sing1.47Å1.53Å
C09C08doub1.40Å1.38ÅAromatic
C09C03sing1.38Å1.38ÅAromatic
C08C06sing1.40Å1.38ÅAromatic
S02C03sing1.76Å1.82Å
S02C01sing1.81Å1.81Å
C03C04doub1.39Å1.39ÅAromatic
C06O07sing1.36Å1.40Å
C06C05doub1.39Å1.39ÅAromatic
C04C05sing1.38Å1.38ÅAromatic
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C01H3sing1.09Å1.10Å
C04H4sing1.08Å1.08Å
C05H5sing1.08Å1.08Å
O07H6sing0.97Å0.95Å
C09H7sing1.08Å1.08Å
O11H8sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
O12C10O11119.5°120.0°
O12C10C08118.6°120.0°
O11C10C08121.8°120.0°
C10O11H8109.5°117.0°
C10C08C09118.3°120.1°
C10C08C06122.0°120.2°
C08C09C03120.3°119.8°
C09C08C06119.7°119.7°
C08C09H7119.8°120.1°
C09C03S02118.7°119.9°
C09C03C04119.9°120.2°
C03C09H7119.8°120.1°
C08C06O07119.9°120.0°
C08C06C05120.3°119.9°
C03S02C01110.1°103.0°
S02C03C04121.3°119.9°
S02C01H1109.5°109.5°
S02C01H2109.4°109.5°
S02C01H3109.5°109.5°
C03C04C05119.9°120.3°
C03C04H4120.1°119.8°
O07C06C05119.9°120.1°
C06O07H6109.5°114.0°
C06C05C04119.9°120.2°
C06C05H5120.0°120.0°
C05C04H4120.0°119.9°
C04C05H5120.1°119.9°
H1C01H2109.5°109.5°
H1C01H3109.4°109.5°
H2C01H3109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
O12C10O11C08179.5°180.0°
O12C10C08C097.1°179.8°
O12C10C08C06172.6°0.0°
O12C10O11H80.0°0.1°
O11C10C08C09173.4°0.2°
O11C10C08C066.9°180.0°
C10C08C09C06179.7°179.8°
C10C08C09C03179.9°179.7°
C10C08C06O070.0°0.0°
C10C08C06C05179.7°179.9°
C10C08C09H70.1°0.1°
C08C10O11H8179.5°180.0°
C08C09C03H7180.0°179.6°
C08C09C03S02179.8°179.7°
C08C09C03C040.4°0.5°
C09C08C06O07179.6°179.8°
C09C08C06C050.1°0.2°
C03C09C08C060.2°0.5°
C09C03S02C04179.8°179.8°
C09C03S02C01164.6°179.8°
C09C03C04C050.4°0.2°
C09C03C04H4179.5°179.7°
C08C06O07C05179.7°180.0°
C08C06C05C040.1°0.0°
C08C06C05H5179.9°180.0°
C08C06O07H6180.0°90.0°
C06C08C09H7179.8°179.9°
S02C03C04C05179.8°180.0°
C03S02C01H1180.0°60.0°
C03S02C01H260.0°180.0°
C03S02C01H360.0°60.0°
S02C03C04H40.2°0.1°
S02C03C09H70.2°0.1°
C01S02C03C0415.2°0.0°
S02C01H1H2120.0°120.0°
S02C01H1H3120.0°120.0°
S02C01H2H3120.0°120.0°
C03C04C05C060.3°0.0°
C03C04C05H4180.0°180.0°
C03C04C05H5179.7°180.0°
C04C03C09H7179.6°179.9°
O07C06C05C04179.6°180.0°
O07C06C05H50.4°0.0°
C06C05C04H5180.0°180.0°
C06C05C04H4179.7°180.0°
C05C06O07H60.3°90.1°
H1C01H2H3120.0°120.0°
H4C04C05H50.3°0.0°

223790

PDB entries from 2024-08-14

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