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A1ANV

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CC1sing1.53Å1.53Å
C2C1sing1.53Å1.54Å
C1C3sing1.53Å1.54Å
NC3sing1.47Å1.46Å
C4Nsing1.38Å1.36Å
C4N1doub1.33Å1.35ÅAromatic
N1C5sing1.32Å1.34ÅAromatic
C5N2doub1.32Å1.33ÅAromatic
N2C6sing1.33Å1.34ÅAromatic
C6N3sing1.37Å1.38ÅAromatic
N3C7sing1.37Å1.38ÅAromatic
SC7sing1.76Å1.74Å
C8Ssing1.81Å1.75Å
OSdoub1.42Å1.44Å
O1Sdoub1.42Å1.44Å
C7C9doub1.34Å1.40ÅAromatic
C9C10sing1.46Å1.42ÅAromatic
C10C4sing1.40Å1.41ÅAromatic
C6C10doub1.41Å1.40ÅAromatic
C3C11sing1.51Å1.52Å
C11C12doub1.38Å1.39ÅAromatic
C12C13sing1.38Å1.39ÅAromatic
C13C14doub1.39Å1.39ÅAromatic
C14C15sing1.38Å1.40ÅAromatic
C16C15doub1.39Å1.39ÅAromatic
C11C16sing1.38Å1.39ÅAromatic
C15S1sing1.77Å1.75Å
O2S1doub1.42Å1.44Å
S1O3doub1.42Å1.43Å
C17S1sing1.82Å1.76Å
C18C17sing1.54Å1.52Å
C19C18sing1.52Å1.51Å
C14C19sing1.50Å1.51Å
N3H1sing0.97Å1.00Å
C5H10sing1.08Å1.08Å
C8H13sing1.09Å1.10Å
C8H12sing1.09Å1.10Å
C8H11sing1.09Å1.10Å
C13H16sing1.08Å1.08Å
C17H18sing1.09Å1.10Å
C17H19sing1.09Å1.10Å
C18H21sing1.09Å1.10Å
C18H20sing1.09Å1.10Å
C19H22sing1.09Å1.10Å
C19H23sing1.09Å1.10Å
C12H15sing1.08Å1.08Å
C16H17sing1.08Å1.08Å
C3Hsing1.09Å1.10Å
C1H5sing1.09Å1.10Å
C2H7sing1.09Å1.10Å
C2H8sing1.09Å1.10Å
C2H6sing1.09Å1.10Å
CH3sing1.09Å1.10Å
CH2sing1.09Å1.10Å
CH4sing1.09Å1.10Å
NH9sing0.97Å1.00Å
C9H14sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CC1C2109.0°109.5°
CC1C3111.8°109.5°
CC1H5108.6°109.5°
C1CH3109.5°109.5°
C1CH2109.5°109.5°
C1CH4109.5°109.5°
C2C1C3110.5°109.5°
C2C1H5108.4°109.4°
C1C2H7109.5°109.5°
C1C2H8109.5°109.4°
C1C2H6109.4°109.4°
C1C3N109.4°109.4°
C1C3C11113.0°109.5°
C1C3H106.9°109.5°
C3C1H5108.4°109.5°
C3NC4125.3°120.0°
NC3C11112.2°109.5°
NC3H107.9°109.5°
C3NH9105.4°120.0°
NC4N1119.0°120.9°
NC4C10121.2°120.8°
C4NH9105.4°120.0°
C4N1C5117.4°121.1°
N1C4C10119.7°118.3°
N1C5N2128.6°122.7°
N1C5H10115.7°118.7°
C5N2C6112.8°120.7°
N2C5H10115.7°118.6°
N2C6N3125.0°134.3°
N2C6C10125.6°118.5°
C6N3C7107.1°110.0°
N3C6C10109.4°107.2°
C6N3H1126.5°125.0°
N3C7S120.6°125.1°
N3C7C9110.8°109.8°
C7N3H1126.5°125.0°
C7SC8104.3°104.5°
C7SO109.1°104.3°
C7SO1106.6°104.3°
SC7C9128.5°125.1°
C8SO108.7°110.5°
C8SO1108.7°110.5°
SC8H13109.5°109.5°
SC8H12109.4°109.5°
SC8H11109.5°109.5°
OSO1118.5°121.0°
C7C9C10105.2°106.8°
C7C9H14127.4°126.6°
C9C10C4136.7°135.2°
C9C10C6107.5°106.2°
C10C9H14127.4°126.6°
C4C10C6115.8°118.7°
C3C11C12121.0°120.3°
C3C11C16121.0°120.3°
C11C3H107.1°109.5°
C11C12C13120.9°119.9°
C12C11C16118.0°119.4°
C11C12H15119.5°120.1°
C12C13C14122.1°121.0°
C12C13H16119.0°119.5°
C13C12H15119.6°120.1°
C13C14C15116.5°118.8°
C13C14C19119.6°116.5°
C14C13H16119.0°119.5°
C14C15C16121.7°120.2°
C14C15S1121.5°121.9°
C15C14C19123.9°124.7°
C15C16C11120.7°120.7°
C16C15S1116.8°117.9°
C15C16H17119.6°119.7°
C11C16H17119.6°119.7°
C15S1O2108.2°104.4°
C15S1O3107.7°104.4°
C15S1C17104.4°103.7°
O2S1O3117.1°121.2°
O2S1C17108.6°110.7°
O3S1C17110.1°110.6°
S1C17C18109.3°107.0°
S1C17H18109.5°109.9°
S1C17H19109.5°110.0°
C17C18C19110.3°109.1°
C18C17H18109.5°109.9°
C18C17H19109.5°110.0°
C17C18H21109.3°109.6°
C17C18H20109.2°109.6°
C18C19C14113.1°113.8°
C19C18H21109.3°109.5°
C19C18H20109.3°109.6°
C18C19H22108.6°108.6°
C18C19H23108.5°108.6°
C14C19H22108.5°108.6°
C14C19H23108.5°108.6°
H13C8H12109.4°109.5°
H13C8H11109.5°109.5°
H12C8H11109.5°109.5°
H18C17H19109.5°110.0°
H21C18H20109.5°109.5°
H22C19H23109.5°108.6°
H7C2H8109.5°109.5°
H7C2H6109.5°109.5°
H8C2H6109.5°109.4°
H3CH2109.5°109.5°
H3CH4109.5°109.4°
H2CH4109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CC1C2C3123.2°120.0°
CC1C2H5118.0°120.0°
CC1C3H5119.7°120.0°
CC1C3N179.7°60.0°
CC1C3C1153.9°60.0°
CC1C3H63.6°180.0°
CC1C2H7180.0°60.0°
CC1C2H860.0°180.0°
CC1C2H660.0°60.1°
C1CH3H2120.0°120.0°
C1CH3H4120.0°120.0°
C1CH2H4120.0°120.0°
C2C1C3H5118.7°119.9°
C2C1C3N58.7°60.0°
C2C1C3C11175.5°180.0°
C2C1C3H58.0°60.0°
C1C2H7H8120.0°120.0°
C1C2H7H6120.0°120.0°
C1C2H8H6120.0°119.9°
C2C1CH3180.0°180.0°
C2C1CH260.0°59.9°
C2C1CH460.0°60.0°
C1C3NC11126.3°120.0°
C1C3NH116.0°120.0°
C1C3NC4144.3°85.1°
C1C3C11H117.5°120.0°
C1C3C11C12109.2°80.0°
C1C3C11C1673.2°100.1°
C3C1C2H756.7°180.0°
C3C1C2H8176.8°59.9°
C3C1C2H663.2°60.0°
C3C1CH357.6°60.0°
C3C1CH262.5°180.0°
C3C1CH4177.6°60.0°
C1C3NH993.5°95.0°
C3NC4H9122.1°179.9°
C3NC4N116.8°0.1°
C3NC4C10167.0°180.0°
NC3C11H118.2°120.0°
NC3C11C12126.5°40.0°
NC3C11C1651.1°140.0°
NC3C1H560.0°180.0°
NC4N1C10176.2°180.0°
NC4N1C5175.6°180.0°
NC4C10C95.4°0.0°
NC4C10C6174.2°180.0°
C4NC3C1189.4°155.0°
C4NC3H28.3°34.9°
C4N1C5N21.8°0.0°
N1C4C10C9178.5°180.0°
N1C4C10C61.9°0.1°
C4N1C5H10178.3°180.0°
N1C4NH9138.9°180.0°
N1C5N2H10180.0°180.0°
N1C5N2C62.4°0.0°
C5N1C4C100.6°0.0°
C5N2C6N3177.2°179.9°
C5N2C6C100.7°0.0°
N2C6N3C10178.2°179.9°
N2C6N3C7179.0°180.0°
N2C6C10C9179.0°180.0°
N2C6C10C41.2°0.0°
N2C6N3H10.9°0.0°
C6N2C5H10177.7°180.0°
C6N3C7H1180.0°180.0°
C6N3C7S178.9°180.0°
C6N3C7C90.5°0.1°
N3C6C10C90.8°0.1°
N3C6C10C4179.4°180.0°
N3C7SC9178.1°179.9°
N3C7SC891.4°90.0°
N3C7SO24.6°153.9°
N3C7SO1153.6°26.1°
N3C7C9C100.0°0.1°
C7N3C6C100.8°0.1°
N3C7C9H14180.0°180.0°
C7SC8O116.3°111.6°
C7SC8O1113.4°111.6°
C7SOO1122.1°116.7°
SC7C9C10178.2°180.0°
SC7N3H11.1°0.0°
C7SC8H13180.0°60.0°
C7SC8H1260.0°180.0°
C7SC8H1160.0°60.0°
SC7C9H141.8°0.1°
C8SOO1124.7°131.5°
C8SC7C990.5°90.1°
SC8H13H12120.0°120.0°
SC8H13H11120.0°120.0°
SC8H12H11120.0°120.0°
OSC7C9153.4°26.0°
OSC8H1363.7°51.6°
OSC8H12176.3°68.4°
OSC8H1156.3°171.6°
O1SC7C924.4°153.8°
O1SC8H1366.5°171.6°
O1SC8H1253.4°68.4°
O1SC8H11173.4°51.6°
C7C9C10H14180.0°180.0°
C7C9C10C4179.9°179.9°
C7C9C10C60.5°0.0°
C9C7N3H1179.5°179.9°
C9C10C4C6179.6°179.9°
C10C4NH944.9°0.1°
C4C10C9H140.1°0.0°
C10C6N3H1179.2°179.9°
C6C10C9H14179.5°180.0°
C3C11C12C16177.7°179.9°
C3C11C12C13176.9°179.6°
C3C11C16C15178.6°179.5°
C3C11C12H153.1°0.3°
C3C11C16H171.5°0.3°
C11C3C1H565.8°60.1°
C11C3NH932.7°24.9°
C11C12C13H15180.0°179.9°
C11C12C13C142.4°0.0°
C12C11C16C150.9°0.5°
C11C12C13H16177.6°179.7°
C12C11C16H17179.1°179.6°
C12C11C3H8.3°160.0°
C12C13C14H16180.0°179.6°
C12C13C14C152.2°0.3°
C13C12C11C160.8°0.4°
C12C13C14C19175.7°178.5°
C13C14C15C19177.8°178.7°
C13C14C15C160.5°0.2°
C13C14C15S1177.1°179.1°
C13C14C19C18156.2°156.7°
C13C14C19H2283.2°35.6°
C13C14C19H2335.7°82.3°
C14C13C12H15177.6°180.0°
C14C15C16S1177.7°179.3°
C14C15C16C111.1°0.2°
C14C15S1O2129.3°103.5°
C14C15S1O3103.2°128.4°
C14C15S1C1713.8°12.5°
C15C14C19C1826.1°24.6°
C15C14C13H16177.8°179.3°
C15C14C19H2294.5°145.6°
C15C14C19H23146.6°96.5°
C14C15C16H17179.0°179.9°
C15C16C11H17180.0°179.9°
C16C15S1O253.0°75.9°
C16C15S1O374.5°52.3°
C16C15S1C17168.5°168.2°
C16C15C14C19177.3°178.5°
C11C16C15S1178.8°179.5°
C16C11C12H15179.2°179.6°
C16C11C3H169.3°20.0°
C15S1O2O3121.9°117.1°
C15S1O2C17112.7°111.0°
C15S1O3C17113.2°111.0°
C15S1C17C1844.3°44.9°
S1C15C14C195.1°2.2°
C15S1C17H1875.6°164.3°
C15S1C17H19164.3°74.5°
S1C15C16H171.3°0.6°
O2S1O3C17124.7°132.0°
O2S1C17C18159.5°66.5°
O2S1C17H1839.6°52.8°
O2S1C17H1980.5°174.1°
O3S1C17C1871.0°156.4°
O3S1C17H18169.0°84.3°
O3S1C17H1949.0°36.9°
S1C17C18H18120.0°119.3°
S1C17C18H19120.0°119.4°
S1C17C18C1970.3°71.4°
S1C17H18H19120.0°121.2°
S1C17C18H21169.6°48.4°
S1C17C18H2049.9°168.6°
C17C18C19H21120.1°119.9°
C17C18C19H20120.1°119.9°
C17C18C19C1459.9°61.6°
C18C17H18H19120.1°121.2°
C17C18H21H20119.6°120.2°
C17C18C19H2260.7°177.4°
C17C18C19H23179.6°59.5°
C18C19C14H22120.6°121.1°
C18C19C14H23120.5°121.1°
C19C18C17H1849.7°169.2°
C19C18C17H19169.8°48.0°
C19C18H21H20119.7°120.2°
C18C19H22H23118.3°117.9°
C19C14C13H164.3°1.9°
C14C19C18H21180.0°58.4°
C14C19C18H2060.2°178.5°
C14C19H22H23118.3°117.9°
H13C8H12H11120.0°120.0°
H16C13C12H152.4°0.4°
H18C17C18H2170.4°70.9°
H18C17C18H20169.9°49.3°
H19C17C18H2149.7°167.9°
H19C17C18H2070.1°71.9°
H21C18C19H2259.4°62.7°
H21C18C19H2359.5°179.4°
H20C18C19H22179.2°57.4°
H20C18C19H2360.3°60.4°
HC3C1H5176.7°60.0°
HC3NH9150.5°145.0°
H5C1C2H762.0°60.0°
H5C1C2H858.1°60.0°
H5C1C2H6178.0°179.9°
H5C1CH362.0°60.0°
H5C1CH2177.9°60.0°
H5C1CH458.0°180.0°
H7C2H8H6120.0°120.1°
H3CH2H4120.0°120.0°

221716

PDB entries from 2024-06-26

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