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OO2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C16C15sing1.55Å1.53Å
C16C12sing1.54Å1.52Å
C15C14sing1.55Å1.49Å
C12C13sing1.54Å1.53Å
C12N5sing1.47Å1.46Å
C14C13sing1.54Å1.51Å
N5C3sing1.38Å1.36Å
C3N1doub1.33Å1.35ÅAromatic
C3C11sing1.40Å1.41ÅAromatic
N1C1sing1.32Å1.33ÅAromatic
C11N4sing1.36Å1.39ÅAromatic
C11C2doub1.40Å1.38ÅAromatic
N4C10doub1.30Å1.31ÅAromatic
C1CL1sing1.74Å1.75Å
C1N2doub1.32Å1.33ÅAromatic
C2N2sing1.33Å1.34ÅAromatic
C2N3sing1.37Å1.37ÅAromatic
C10N3sing1.36Å1.37ÅAromatic
N3C9sing1.46Å1.46Å
O1C4sing1.43Å1.42Å
C4C5sing1.54Å1.53Å
C4C6sing1.54Å1.52Å
C5O2sing1.43Å1.42Å
C5C9sing1.54Å1.53Å
C9O7sing1.44Å1.42Å
O4P1doub1.48Å1.49Å
C7C6sing1.53Å1.50Å
C7O3sing1.43Å1.40Å
C6O7sing1.44Å1.44Å
P1O6sing1.61Å1.54Å
P1C8sing1.82Å1.80Å
P1O5sing1.61Å1.54Å
C8O3sing1.43Å1.42Å
O1H1sing0.97Å0.95Å
C4H2sing1.09Å1.10Å
C5H3sing1.09Å1.10Å
O2H4sing0.97Å0.95Å
C6H5sing1.09Å1.10Å
C7H6sing1.09Å1.10Å
C7H7sing1.09Å1.10Å
C8H8sing1.09Å1.10Å
C8H9sing1.09Å1.10Å
O5H10sing0.97Å0.95Å
O6H11sing0.97Å0.95Å
C9H12sing1.09Å1.10Å
C10H13sing1.08Å1.08Å
N5H14sing0.97Å1.00Å
C12H15sing1.09Å1.10Å
C13H16sing1.09Å1.10Å
C13H17sing1.09Å1.10Å
C14H18sing1.09Å1.10Å
C14H19sing1.09Å1.10Å
C15H20sing1.09Å1.10Å
C15H21sing1.09Å1.10Å
C16H22sing1.09Å1.10Å
C16H23sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C15C16C12105.2°104.2°
C16C15C14108.3°102.7°
C16C15H20109.8°110.7°
C16C15H21109.8°110.9°
C15C16H22110.5°110.4°
C15C16H23110.5°110.5°
C16C12C13102.6°106.6°
C16C12N5111.9°110.0°
C16C12H15109.7°110.1°
C12C16H22110.5°110.5°
C12C16H23110.5°110.5°
C15C14C13104.1°104.2°
C15C14H18110.8°110.5°
C15C14H19110.8°110.6°
C14C15H20109.8°110.8°
C14C15H21109.8°110.7°
C13C12N5112.1°110.0°
C12C13C14104.6°106.6°
C13C12H15109.7°110.0°
C12C13H16110.7°110.0°
C12C13H17110.7°110.1°
C12N5C3127.7°120.0°
C12N5H14104.7°119.9°
N5C12H15110.6°110.0°
C14C13H16110.7°110.0°
C14C13H17110.7°110.1°
C13C14H18110.8°110.5°
C13C14H19110.8°110.5°
N5C3N1119.5°120.7°
N5C3C11121.4°120.8°
C3N5H14104.8°120.0°
N1C3C11119.1°118.5°
C3N1C1116.9°121.1°
C3C11N4133.0°134.6°
C3C11C2116.2°118.2°
N1C1CL1115.3°118.8°
N1C1N2130.0°122.4°
N4C11C2110.8°107.1°
C11N4C10103.7°109.5°
C11C2N2126.5°119.1°
C11C2N3105.9°106.0°
N4C10N3114.0°109.9°
N4C10H13123.0°125.0°
CL1C1N2114.5°118.8°
C1N2C2111.3°120.6°
N2C2N3127.7°134.9°
C2N3C10105.7°107.5°
C2N3C9126.7°126.2°
C10N3C9127.6°126.3°
N3C10H13123.0°125.0°
N3C9C5113.5°110.4°
N3C9O7109.8°110.4°
N3C9H12108.7°110.4°
O1C4C5116.5°110.5°
O1C4C6109.8°110.5°
C4O1H1109.5°114.0°
O1C4H2110.2°110.4°
C5C4C6102.5°104.1°
C4C5O2115.3°110.5°
C4C5C9102.2°104.1°
C5C4H2108.6°110.5°
C4C5H3109.0°110.5°
C4C6C7113.1°110.4°
C4C6O7104.8°104.7°
C6C4H2108.8°110.6°
C4C6H5109.0°110.4°
O2C5C9110.5°110.5°
O2C5H3110.6°110.5°
C5O2H4109.5°114.0°
C5C9O7107.9°104.8°
C9C5H3108.9°110.6°
C5C9H12107.7°110.3°
C9O7C6109.3°105.3°
O7C9H12109.1°110.4°
O4P1O6111.8°109.5°
O4P1C8114.4°109.5°
O4P1O5112.5°109.5°
C6C7O3108.5°109.5°
C7C6O7110.5°110.4°
C7C6H5109.3°110.5°
C6C7H6109.7°109.5°
C6C7H7109.7°109.5°
C7O3C8111.5°114.0°
O3C7H6109.7°109.5°
O3C7H7109.7°109.4°
O7C6H5110.1°110.4°
O6P1C8103.3°109.5°
O6P1O5110.0°109.5°
P1O6H11109.5°114.0°
C8P1O5104.4°109.4°
P1C8O3111.7°109.4°
P1C8H8108.9°109.5°
P1C8H9108.9°109.4°
P1O5H10109.5°114.0°
O3C8H8108.9°109.5°
O3C8H9108.9°109.5°
H6C7H7109.5°109.4°
H8C8H9109.5°109.5°
H16C13H17109.4°110.0°
H18C14H19109.5°110.4°
H20C15H21109.4°110.7°
H22C16H23109.5°110.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C15C16C12H22119.3°118.6°
C15C16C12H23119.3°118.7°
C16C15C14H20119.8°118.3°
C16C15C14H21119.8°118.5°
C15C16C12C1327.8°23.6°
C15C16C12N592.5°142.9°
C16C15C14C1317.2°37.9°
C15C16C12H15144.4°95.7°
C16C15C14H18101.9°156.6°
C16C15C14H19136.4°80.8°
C16C15H20H21120.5°123.4°
C15C16H22H23122.0°122.6°
C12C16C15C146.9°37.9°
C16C12C13N5120.2°119.3°
C16C12C13H15116.6°119.4°
C16C12N5H15122.6°121.4°
C16C12C13C1439.1°0.0°
C16C12N5C3139.1°87.8°
C16C12N5H1416.7°92.2°
C16C12C13H1680.2°119.2°
C16C12C13H17158.3°119.3°
C12C16C15H20112.9°80.4°
C12C16C15H21126.7°156.3°
C12C16H22H23122.0°122.7°
C15C14C13C1235.0°23.6°
C15C14C13H18119.1°118.7°
C15C14C13H19119.1°118.9°
C15C14C13H1684.3°95.6°
C15C14C13H17154.2°142.9°
C15C14H18H19122.5°122.7°
C14C15H20H21120.6°123.2°
C14C15C16H22112.5°80.7°
C14C15C16H23126.2°156.6°
C13C12N5H15122.8°121.4°
C12C13C14H16119.3°119.2°
C12C13C14H17119.2°119.3°
C13C12N5C3106.2°155.0°
C13C12N5H14131.4°25.1°
C12C13H16H17122.2°121.4°
C12C13C14H1884.1°142.3°
C12C13C14H19154.1°95.2°
C13C12C16H2291.5°95.0°
C13C12C16H23147.2°142.3°
N5C12C13C1481.1°119.3°
C12N5C3H14122.4°180.0°
C12N5C3N119.5°0.0°
C12N5C3C11160.6°180.0°
N5C12C13H16159.6°121.4°
N5C12C13H1738.1°0.0°
N5C12C16H22148.2°24.3°
N5C12C16H2326.8°98.4°
C14C13C12H15155.7°119.4°
C14C13H16H17122.2°121.5°
C13C14H18H19122.5°122.5°
C13C14C15H20137.1°80.3°
C13C14C15H21102.6°156.4°
N5C3N1C11179.9°180.0°
N5C3N1C1178.5°180.0°
N5C3C11N40.4°0.0°
N5C3C11C2179.8°179.8°
C3N5C12H1516.5°33.6°
N1C3C11N4179.7°180.0°
N1C3C11C20.1°0.3°
C3N1C1CL1172.2°180.0°
C3N1C1N22.8°0.2°
N1C3N5H14141.9°180.0°
C11C3N1C11.4°0.0°
C3C11N4C2179.8°179.8°
C3C11N4C10179.8°179.7°
C3C11C2N20.3°0.3°
C3C11C2N3179.9°179.8°
C11C3N5H1438.2°0.0°
N1C1CL1N2175.8°179.8°
N1C1N2C22.3°0.2°
N4C11C2N2179.9°179.9°
N4C11C2N30.3°0.0°
C11N4C10N30.3°0.1°
C11N4C10H13179.7°179.9°
C2C11N4C100.4°0.1°
C11C2N2C10.6°0.1°
C11C2N2N3179.5°179.9°
C11C2N3C100.1°0.0°
C11C2N3C9178.5°180.0°
N4C10N3C20.2°0.1°
N4C10N3H13180.0°179.9°
N4C10N3C9178.2°179.9°
CL1C1N2C2172.7°179.9°
C1N2C2N3178.8°180.0°
N2C2N3C10179.6°180.0°
N2C2N3C92.0°0.0°
C2N3C10C9178.3°180.0°
C2N3C9C574.8°85.0°
C2N3C9O7164.3°159.6°
C2N3C9H1245.0°37.3°
C2N3C10H13179.8°180.0°
C10N3C9C5103.2°95.0°
C10N3C9O717.7°20.4°
C10N3C9H12137.0°142.7°
N3C9C5C4103.0°142.8°
N3C9C5O2133.8°98.6°
N3C9C5O7121.9°118.9°
N3C9C5H12120.4°122.3°
N3C9O7H12119.0°122.4°
N3C9O7C6127.8°159.3°
N3C9C5H312.1°24.1°
C9N3C10H131.8°0.0°
O1C4C5C6119.8°118.6°
O1C4C5H2125.1°122.6°
O1C4C6H2120.7°122.6°
O1C4C5O232.7°0.0°
O1C4C5C9152.6°118.7°
O1C4C6C779.2°98.5°
O1C4C6O7160.4°142.7°
O1C4C5H392.3°122.6°
O1C4C6H542.6°23.9°
C5C4C6H2114.9°118.8°
C4C5O2C9115.2°114.6°
C4C5O2H3124.1°122.6°
C4C5C9H3115.2°118.7°
C4C5C9O718.9°23.9°
C5C4C6C7156.4°142.8°
C5C4C6O736.0°24.0°
C5C4O1H1180.0°61.4°
C4C5O2H4180.0°61.5°
C5C4C6H581.8°94.8°
C4C5C9H12136.6°94.9°
C6C4C5O287.1°118.6°
C6C4C5C932.8°0.0°
C4C6O7C925.1°40.5°
C4C6C7O7117.1°115.3°
C4C6C7H5121.7°122.4°
C4C6C7O3175.3°175.1°
C4C6O7H5117.1°118.8°
C6C4O1H164.2°176.1°
C6C4C5H3147.9°118.8°
C4C6C7H655.4°55.0°
C4C6C7H764.9°65.0°
O2C5C9H3121.6°122.7°
O2C5C9O7104.3°142.6°
O2C5C4H2157.8°122.6°
O2C5C9H1213.4°23.8°
C5C9O7H12116.8°118.8°
C5C9O7C63.6°40.5°
C9C5C4H282.3°118.8°
C9C5O2H464.8°176.1°
C9O7C6C7147.2°159.3°
O7C9C5H3134.1°94.7°
C9O7C6H592.0°78.3°
O4P1O6C8123.4°120.0°
O4P1O6O5125.7°120.0°
O4P1C8O5123.3°120.0°
O4P1C8O3117.8°60.0°
O4P1C8H82.5°60.0°
O4P1C8H9121.9°180.0°
O4P1O5H100.0°60.0°
O4P1O6H110.0°179.9°
C6C7O3H6119.8°120.0°
C6C7O3H7119.9°120.0°
C7C6O7H5120.7°122.4°
C6C7O3C8158.4°180.0°
C7C6C4H241.5°24.0°
C6C7H6H7120.5°120.0°
O3C7C6O767.7°69.6°
C7O3C8P193.7°75.0°
O3C7C6H553.6°52.7°
O3C7H6H7120.4°120.0°
C7O3C8H826.6°165.0°
C7O3C8H9146.0°44.9°
O7C6C4H278.9°94.8°
O7C6C7H6172.5°170.4°
O7C6C7H752.2°50.4°
C6O7C9H12113.2°78.3°
O6P1C8O5115.0°120.0°
O6P1C8O33.9°60.0°
O6P1C8H8124.2°180.0°
O6P1C8H9116.4°60.0°
O6P1O5H10125.3°60.0°
P1C8O3H8120.3°120.0°
P1C8O3H9120.3°119.9°
P1C8H8H9119.0°119.9°
C8P1O5H10124.5°180.0°
C8P1O6H11123.4°60.0°
O5P1C8O3118.9°180.0°
O5P1C8H8120.8°60.0°
O5P1C8H91.4°60.0°
O5P1O6H11125.7°60.0°
C8O3C7H681.8°59.9°
C8O3C7H738.5°60.0°
O3C8H8H9119.0°120.1°
H1O1C4H255.7°61.2°
H2C4C5H332.8°0.0°
H2C4C6H5163.3°146.4°
H3C5O2H455.9°61.1°
H3C5C9H12108.2°146.5°
H5C6C7H666.3°67.3°
H5C6C7H7173.4°172.7°
H14N5C12H15105.9°146.4°
H15C12C13H1636.4°0.1°
H15C12C13H1785.1°121.3°
H15C12C16H2225.1°145.6°
H15C12C16H2396.3°22.9°
H16C13C14H18156.6°23.0°
H16C13C14H1934.9°145.5°
H17C13C14H1835.1°98.4°
H17C13C14H1986.6°24.1°
H18C14C15H2017.9°38.3°
H18C14C15H21138.3°84.9°
H19C14C15H20103.8°160.9°
H19C14C15H2116.6°37.7°
H20C15C16H22127.7°161.0°
H20C15C16H236.4°38.3°
H21C15C16H227.4°37.7°
H21C15C16H23114.0°85.0°

226262

PDB entries from 2024-10-16

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