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SummaryGeometryPCM/PTMRelated PDB entries

4A6

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C1C2sing1.51Å1.50Å
C2C3sing1.38Å1.45ÅAromatic
C2C10doub1.38Å1.44ÅAromatic
C2RUsing2.23Å2.23Å
C3C4doub1.38Å1.44ÅAromatic
C3RUsing2.20Å2.25Å
C4C5sing1.39Å1.45ÅAromatic
C4RUsing2.20Å2.28Å
C5C6sing1.54Å1.52Å
C5C9doub1.39Å1.48ÅAromatic
C5RUsing2.23Å2.24Å
C6C7sing1.54Å1.54Å
C6C8sing1.54Å1.53Å
C9C10sing1.38Å1.42ÅAromatic
C9RUsing2.20Å2.20Å
C10RUsing2.20Å2.19Å
C1H1sing0.97Å1.10Å
C1H2sing0.97Å1.10Å
C1H3sing0.97Å1.10Å
C6H6sing0.99Å1.10Å
C7H7sing0.97Å1.10Å
C7H8sing0.97Å1.10Å
C7H9sing0.97Å1.10Å
C8H10sing0.97Å1.10Å
C8H11sing0.97Å1.10Å
C8H12sing0.97Å1.10Å
C4H4sing0.94Å1.10Å
C3H5sing0.94Å1.10Å
C10H14sing0.94Å1.10Å
C9H13sing0.94Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C1C2C3120.1°121.2°
C1C2C10119.1°121.1°
C1C2RU125.5°129.3°
C2C1H1109.5°109.9°
C2C1H2109.5°109.8°
C2C1H3109.5°109.6°
C3C2C10120.4°117.6°
C3C2RU72.0°70.8°
C2C3C4119.6°121.4°
C2C3RU70.4°72.8°
C2C3H5117.7°119.1°
C10C2RU69.5°70.8°
C2C10C9119.2°121.4°
C2C10RU72.4°72.9°
C2C10H14118.1°119.2°
C2RUC337.7°36.4°
C2RUC467.1°66.0°
C2RUC581.3°78.8°
C2RUC967.7°66.0°
C2RUC1038.0°36.4°
C4C3RU72.6°71.7°
C3C4C5121.4°121.2°
C3C4RU70.5°71.7°
C3C4H4115.6°119.2°
C4C3H5117.9°119.5°
C3RUC437.0°36.6°
C3RUC568.2°66.2°
C3RUC980.2°77.1°
C3RUC1068.7°65.0°
RUC3H5107.4°128.6°
C5C4RU69.6°72.6°
C4C5C6121.0°122.3°
C4C5C9116.8°117.1°
C4C5RU72.9°70.7°
C5C4H4115.4°119.6°
C4RUC537.4°36.7°
C4RUC967.6°65.3°
C4RUC1080.5°77.1°
RUC4H4105.8°128.6°
C6C5C9122.2°120.6°
C6C5RU128.9°129.5°
C5C6C7111.9°113.1°
C5C6C8112.8°113.0°
C5C6H6107.0°106.0°
C9C5RU69.1°70.7°
C5C9C10122.3°121.2°
C5C9RU72.0°72.7°
C5C9H13115.5°119.5°
C5RUC938.9°36.6°
C5RUC1069.8°66.2°
C7C6C8111.2°111.4°
C7C6H6106.7°106.3°
C6C7H7109.5°109.8°
C6C7H8109.5°109.8°
C6C7H9109.4°109.4°
C8C6H6106.8°106.3°
C6C8H10109.5°109.3°
C6C8H11109.5°109.8°
C6C8H12109.4°109.8°
C10C9RU71.0°71.6°
C9C10RU71.4°71.7°
C9C10H14118.7°119.4°
C10C9H13116.7°119.3°
C9RUC1037.6°36.6°
RUC9H13106.8°128.5°
RUC10H14108.1°128.6°
H1C1H2109.5°109.1°
H1C1H3109.5°109.3°
H2C1H3109.5°109.2°
H7C7H8109.5°109.4°
H7C7H9109.5°109.2°
H8C7H9109.5°109.2°
H10C8H11109.4°109.2°
H10C8H12109.5°109.2°
H11C8H12109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C1C2C3C10173.0°179.8°
C1C2C3RU121.1°124.9°
C1C2C10RU120.1°124.9°
C1C2C3C4176.5°179.9°
C1C2RUC4143.8°143.9°
C1C2RUC5180.0°179.9°
C1C2C10C9175.9°180.0°
C1C2RUC9142.1°143.7°
C2C1H1H2120.0°120.4°
C2C1H1H3120.0°120.2°
C2C1H2H3120.0°120.2°
C1C2C3H521.3°0.2°
C1C2C10H1418.6°0.2°
C3C2C10RU53.0°54.9°
C2C3C4RU54.3°55.5°
C2C3C4H5155.1°179.9°
C2C3RUH5113.9°113.9°
C2C3C4C54.7°0.2°
C2C3RUC5104.5°103.8°
C3C2C10C92.9°0.2°
C2C3RUC965.9°66.8°
C3C2C1H1180.0°149.8°
C3C2C1H260.0°29.8°
C3C2C1H360.0°90.1°
C2C3C4H4153.0°179.9°
C3C2C10H14154.5°180.0°
C10C2C3C43.5°0.2°
C2C10RUC464.8°66.8°
C2C10C9C53.5°0.2°
C2C10RUC5102.1°103.8°
C2C10C9RU56.4°55.6°
C2C10C9H14157.2°179.8°
C2C10RUH14114.6°114.0°
C10C2C1H16.9°30.5°
C10C2C1H2113.1°150.5°
C10C2C1H3126.9°89.6°
C10C2C3H5151.7°180.0°
C2C10C9H13156.1°180.0°
C2RUC5C463.4°64.7°
C2RUC4C974.2°73.4°
C2RUC5C6179.9°178.9°
C2RUC9C5104.4°104.0°
RUC2C1H191.5°120.3°
RUC2C1H228.5°119.7°
RUC2C1H3148.5°0.2°
C2RUC4H4141.9°141.8°
C2RUC9H13143.6°141.8°
C4C3RUH5114.6°113.6°
C3C4C5RU49.9°54.9°
C3C4C5H4148.3°179.9°
C3C4RUH4112.1°113.2°
C3C4C5C6175.5°179.9°
C3C4C5C95.2°0.2°
C3C4RUC9104.0°102.0°
C3C4RUC1067.0°65.2°
C3RUC5C6143.1°145.2°
C3RUC9C567.3°67.3°
C3RUC5C1074.3°71.9°
C3RUC10C9102.0°102.4°
C3RUC10H14143.0°144.1°
C3RUC9H13179.3°178.4°
C5C4RUH4111.8°114.3°
C4C5C6C9179.3°179.8°
C4C5C6RU92.6°90.8°
C4C5C9RU57.0°55.1°
C4C5C6C762.3°63.5°
C4C5C6C863.9°64.2°
C4C5C9C104.6°0.2°
C4C5RUC10101.0°100.6°
C4C5C6H6178.9°179.7°
C5C4C3H5150.4°180.0°
C4C5C9H13157.5°180.0°
C4RUC10C965.5°65.7°
C4RUC10H14179.4°179.2°
C4RUC9H13143.0°144.8°
C6C5C9RU123.6°125.1°
C5C6C7C8127.1°128.5°
C5C6C7H6116.8°116.0°
C5C6C8H6117.3°115.9°
C6C5C9C10176.0°180.0°
C6C5RUC10142.6°142.9°
C5C6C7H7180.0°68.6°
C5C6C7H860.0°171.2°
C5C6C7H960.0°51.3°
C5C6C8H10180.0°51.4°
C5C6C8H1160.0°171.2°
C5C6C8H1260.0°68.4°
C6C5C4H427.2°0.1°
C6C5C9H1323.2°0.2°
C9C5C6C7118.3°116.7°
C9C5C6C8115.4°115.5°
C5C9C10RU52.8°55.4°
C5C9C10H13152.6°179.8°
C5C9RUH13112.0°114.2°
C9C5C6H61.7°0.5°
C9C5C4H4153.5°179.9°
C5C9C10H14153.7°179.9°
RUC5C6C730.3°27.3°
RUC5C6C8156.5°155.1°
RUC5C6H686.3°88.9°
C5RUC3H5141.6°142.3°
C5RUC10H14143.3°142.2°
C7C6C8H6116.1°115.5°
C6C7H7H8120.0°120.6°
C6C7H7H9120.0°119.9°
C6C7H8H9120.0°119.9°
C7C6C8H1053.4°180.0°
C7C6C8H11173.3°60.2°
C7C6C8H1266.7°60.2°
C8C6C7H752.9°60.0°
C8C6C7H867.1°60.3°
C8C6C7H9172.9°179.9°
C6C8H10H11120.0°120.1°
C6C8H10H12120.0°120.1°
C6C8H11H12120.0°120.6°
C10C9RUH13113.1°113.2°
C9C10RUH14115.0°113.5°
C9RUC4H4143.9°144.8°
C9RUC3H5179.8°179.3°
C10RUC4H4179.2°178.4°
C10RUC3H5142.5°144.0°
H1C1H2H3120.0°119.4°
H6C6C7H763.2°175.5°
H6C6C7H8176.8°55.2°
H6C6C7H956.8°64.7°
H6C6C8H1062.7°64.5°
H6C6C8H1157.3°55.2°
H6C6C8H12177.3°175.7°
H7C7H8H9120.0°119.5°
H10C8H11H12120.0°119.5°
H4C4C3H52.2°0.0°
H14C10C9H131.1°0.1°

260896

PDB entries from 2026-10-14

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