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SummaryGeometryRelated PDB entries

C0A

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
C01N02sing1.47Å1.48Å
N02C03sing1.35Å1.38Å
C23S22sing1.81Å1.76Å
O25S22doub1.42Å1.42Å
N21S22sing1.66Å1.66Å
N21C05sing1.47Å1.48Å
C03C05sing1.51Å1.56Å
C03O04doub1.21Å1.25Å
S22O24doub1.42Å1.41Å
C06C05sing1.53Å1.56Å
C06C07sing1.51Å1.51Å
C08C09doub1.38Å1.41ÅAromatic
C08C07sing1.38Å1.40ÅAromatic
C09C10sing1.38Å1.42ÅAromatic
C07C20doub1.38Å1.40ÅAromatic
F13C11sing1.40Å1.38Å
O16P14doub1.48Å1.51Å
C20C18sing1.38Å1.39ÅAromatic
C10C18doub1.38Å1.40ÅAromatic
C10C11sing1.51Å1.50Å
C18BR1sing1.89Å2.01Å
C11P14sing1.82Å1.96Å
C11F12sing1.40Å1.38Å
P14O15sing1.61Å1.50Å
P14O17sing1.61Å1.51Å
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C01H3sing1.09Å1.10Å
N02H4sing0.97Å1.00Å
C05H5sing1.09Å1.10Å
C06H6sing1.09Å1.10Å
C06H7sing1.09Å1.10Å
C08H8sing1.08Å1.08Å
C09H9sing1.08Å1.08Å
O15H10sing0.97Å0.95Å
O17H11sing0.97Å0.95Å
C20H12sing1.08Å1.08Å
N21H13sing0.97Å1.00Å
C23H14sing1.09Å1.10Å
C23H15sing1.09Å1.10Å
C23H16sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C01N02C03121.4°120.1°
N02C01H1109.5°109.5°
N02C01H2109.5°109.5°
N02C01H3109.5°109.5°
C01N02H4119.3°120.0°
N02C03C05120.9°120.0°
N02C03O04119.1°120.0°
C03N02H4119.3°119.9°
C23S22O25110.8°110.6°
C23S22N21104.4°104.5°
C23S22O24108.4°110.6°
S22C23H14109.5°109.5°
S22C23H15109.4°109.5°
S22C23H16109.5°109.5°
O25S22N21111.1°104.3°
O25S22O24112.4°121.0°
S22N21C05119.9°120.0°
N21S22O24109.5°104.2°
S22N21H13106.8°120.0°
N21C05C03110.2°109.5°
N21C05C06111.6°109.4°
N21C05H5109.4°109.4°
C05N21H13106.8°120.0°
C05C03O04120.0°120.0°
C03C05C06108.9°109.5°
C03C05H5108.4°109.5°
C05C06C07114.5°109.5°
C06C05H5108.3°109.5°
C05C06H6108.2°109.4°
C05C06H7108.2°109.5°
C06C07C08120.7°120.0°
C06C07C20121.3°120.0°
C07C06H6108.2°109.5°
C07C06H7108.2°109.4°
C09C08C07120.2°120.0°
C08C09C10122.8°120.0°
C09C08H8119.9°120.0°
C08C09H9118.6°120.0°
C08C07C20118.0°120.0°
C07C08H8119.9°120.0°
C09C10C18114.5°120.0°
C09C10C11118.7°120.0°
C10C09H9118.6°120.0°
C07C20C18120.5°120.0°
C07C20H12119.7°120.0°
F13C11C10108.2°109.4°
F13C11P14107.0°109.5°
F13C11F12101.4°109.5°
O16P14C11100.8°109.4°
O16P14O15115.3°109.5°
O16P14O17117.2°109.5°
C20C18C10123.9°119.9°
C20C18BR1114.8°120.0°
C18C20H12119.7°120.0°
C18C10C11126.7°120.0°
C10C18BR1121.3°120.0°
C10C11P14116.6°109.5°
C10C11F12111.6°109.5°
P14C11F12110.7°109.5°
C11P14O15100.5°109.5°
C11P14O17102.3°109.5°
O15P14O17116.3°109.5°
P14O15H10109.5°114.0°
P14O17H11109.5°114.0°
H1C01H2109.5°109.5°
H1C01H3109.5°109.5°
H2C01H3109.5°109.5°
H6C06H7109.5°109.5°
H14C23H15109.5°109.5°
H14C23H16109.4°109.4°
H15C23H16109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
C01N02C03H4180.0°180.0°
C01N02C03C05179.4°180.0°
C01N02C03O041.3°0.0°
N02C01H1H2120.0°120.0°
N02C01H1H3120.0°120.0°
N02C01H2H3120.0°120.0°
N02C03C05N2153.3°180.0°
N02C03C05O04178.1°179.9°
N02C03C05C0669.4°60.0°
C03N02C01H1180.0°60.0°
C03N02C01H260.0°180.0°
C03N02C01H360.0°60.0°
N02C03C05H5172.9°60.1°
C23S22O25N21115.5°111.8°
C23S22O25O24121.4°131.5°
C23S22N21O24115.8°116.1°
C23S22N21C0584.6°65.0°
C23S22N21H13153.9°115.0°
S22C23H14H15120.0°120.0°
S22C23H14H16120.0°120.0°
S22C23H15H16120.0°120.0°
O25S22N21O24124.7°127.8°
O25S22N21C05156.0°51.1°
O25S22N21H1334.5°129.0°
O25S22C23H14180.0°171.6°
O25S22C23H1560.0°68.4°
O25S22C23H1660.0°51.7°
S22N21C05H13121.5°179.9°
S22N21C05C0388.3°95.0°
S22N21C05C06150.6°145.0°
S22N21C05H530.8°25.0°
N21S22C23H1460.4°60.0°
N21S22C23H1559.6°180.0°
N21S22C23H16179.6°60.0°
N21C05C03C06122.7°120.0°
N21C05C03H5119.7°120.0°
N21C05C03O04128.6°0.0°
C05N21S22O2431.3°178.9°
N21C05C06H5120.5°119.9°
N21C05C06C07176.9°65.0°
N21C05C06H662.4°55.0°
N21C05C06H756.1°175.0°
C03C05C06H5117.6°120.0°
C03C05C06C0755.0°175.0°
C05C03N02H40.6°0.1°
C03C05C06H6175.8°65.0°
C03C05C06H765.7°55.0°
C03C05N21H13150.3°85.0°
O04C03C05C06108.7°120.0°
O04C03N02H4178.7°180.0°
O04C03C05H59.0°120.0°
O24S22N21H1390.2°1.1°
O24S22C23H1456.3°51.6°
O24S22C23H15176.3°68.4°
O24S22C23H1663.7°171.6°
C05C06C07H6120.7°120.0°
C05C06C07H7120.7°120.0°
C05C06C07C08120.1°89.7°
C05C06C07C2059.5°90.0°
C05C06H6H7117.7°120.0°
C06C05N21H1329.2°35.1°
C06C07C08C09180.0°180.0°
C06C07C08C20179.5°179.7°
C06C07C20C18179.8°179.8°
C07C06C05H562.6°54.9°
C07C06H6H7117.7°120.0°
C06C07C08H80.0°0.1°
C06C07C20H120.2°0.0°
C09C08C07H8180.0°180.0°
C08C09C10H9180.0°180.0°
C09C08C07C200.5°0.3°
C08C09C10C180.5°0.0°
C08C09C10C11180.0°180.0°
C07C08C09C100.1°0.0°
C08C07C20C180.7°0.6°
C08C07C06H6119.2°150.3°
C08C07C06H70.7°30.3°
C07C08C09H9179.9°180.0°
C08C07C20H12179.3°179.7°
C09C10C11F1330.3°121.4°
C09C10C18C200.3°0.3°
C09C10C18C11179.4°180.0°
C09C10C18BR1179.2°180.0°
C09C10C11P1490.3°1.4°
C09C10C11F12141.1°118.6°
C10C09C08H8179.9°180.0°
C07C20C18H12180.0°179.7°
C07C20C18C100.3°0.6°
C07C20C18BR1179.9°179.8°
C20C07C06H661.3°30.0°
C20C07C06H7179.8°150.0°
C20C07C08H8179.5°179.7°
F13C11P14O1660.5°54.5°
F13C11C10C18149.1°58.6°
F13C11C10P14120.6°120.0°
F13C11C10F12110.8°120.0°
F13C11P14F12109.7°120.0°
F13C11P14O1558.1°174.6°
F13C11P14O17178.3°65.4°
O16P14C11C1060.8°174.5°
O16P14C11O15118.6°120.0°
O16P14C11O17121.3°120.0°
O16P14C11F12170.2°65.5°
O16P14O15O17143.1°120.0°
O16P14O15H100.0°174.0°
O16P14O17H110.0°60.1°
C20C18C10BR1179.6°179.7°
C20C18C10C11179.7°179.7°
C18C10C11P1490.3°178.6°
C18C10C11F1238.3°61.4°
C18C10C09H9179.5°180.0°
C10C18C20H12179.7°179.7°
C11C10C18BR10.1°0.0°
C10C11P14F12129.0°120.0°
C10C11P14O15179.4°65.5°
C10C11P14O1760.5°54.5°
C11C10C09H90.1°0.0°
BR1C18C20H120.1°0.0°
C11P14O15O17109.5°120.0°
C11P14O15H10107.4°54.0°
C11P14O17H11109.2°180.0°
F12C11P14O1551.6°54.5°
F12C11P14O1768.6°174.5°
O15P14O17H11142.4°60.0°
O17P14O15H10143.0°66.0°
H1C01H2H3120.0°120.0°
H1C01N02H40.0°120.0°
H2C01N02H4120.0°0.0°
H3C01N02H4120.0°120.0°
H5C05C06H658.1°175.0°
H5C05C06H7176.6°65.1°
H5C05N21H1390.7°155.0°
H8C08C09H90.1°0.0°
H14C23H15H16120.0°120.0°

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PDB entries from 2024-10-09

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