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F82

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
N1C5doub1.31Å1.32ÅAromatic
N1Nsing1.40Å1.36ÅAromatic
C5C4sing1.40Å1.40ÅAromatic
C2C1sing1.53Å1.52Å
C1Nsing1.46Å1.48Å
C1Csing1.53Å1.51Å
NC3sing1.36Å1.35ÅAromatic
C4C3doub1.36Å1.36ÅAromatic
C4N2sing1.41Å1.40Å
N2C6sing1.35Å1.36Å
C6C7sing1.51Å1.52Å
C6Odoub1.21Å1.23Å
C14O1sing1.43Å1.44Å
O1C13sing1.36Å1.36Å
C7C8sing1.51Å1.51Å
C13C8doub1.39Å1.41ÅAromatic
C13C12sing1.39Å1.39ÅAromatic
C8C9sing1.38Å1.39ÅAromatic
C12C11doub1.39Å1.39ÅAromatic
C9C10doub1.38Å1.39ÅAromatic
C11C10sing1.39Å1.38ÅAromatic
C11O2sing1.36Å1.38Å
N4C22doub1.32Å1.34ÅAromatic
N4C15sing1.32Å1.32ÅAromatic
C22N3sing1.31Å1.33ÅAromatic
O2C15sing1.35Å1.36Å
C15C16doub1.41Å1.43ÅAromatic
N3C21doub1.34Å1.37ÅAromatic
C16C21sing1.42Å1.41ÅAromatic
C16C17sing1.40Å1.42ÅAromatic
C21C20sing1.40Å1.41ÅAromatic
C17C18doub1.37Å1.37ÅAromatic
C20C19doub1.37Å1.37ÅAromatic
C18C19sing1.40Å1.42ÅAromatic
C18O4sing1.36Å1.37Å
C19O3sing1.36Å1.37Å
O4C24sing1.43Å1.43Å
O3C23sing1.43Å1.43Å
C1H1sing1.09Å1.10Å
C2H2sing1.09Å1.10Å
C2H3sing1.09Å1.10Å
C2H4sing1.09Å1.10Å
C3H5sing1.08Å1.08Å
C7H6sing1.09Å1.10Å
C7H7sing1.09Å1.10Å
C9H8sing1.08Å1.08Å
C10H9sing1.08Å1.08Å
C12H10sing1.08Å1.08Å
C14H11sing1.09Å1.10Å
C14H12sing1.09Å1.10Å
C14H13sing1.09Å1.10Å
C20H14sing1.08Å1.08Å
C22H15sing1.08Å1.08Å
C24H16sing1.09Å1.10Å
C24H17sing1.09Å1.10Å
C24H18sing1.09Å1.10Å
N2H19sing0.97Å1.00Å
C5H20sing1.08Å1.08Å
CH21sing1.09Å1.10Å
CH22sing1.09Å1.10Å
CH23sing1.09Å1.10Å
C23H24sing1.09Å1.10Å
C23H25sing1.09Å1.10Å
C23H26sing1.09Å1.10Å
C17H27sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C5N1N104.2°108.4°
N1C5C4111.6°108.3°
N1C5H20124.2°125.9°
N1NC1118.7°126.0°
N1NC3112.6°107.9°
C5C4C3105.6°107.8°
C5C4N2123.2°126.1°
C4C5H20124.2°125.8°
C2C1N110.0°109.5°
C2C1C111.1°109.4°
C2C1H1108.5°109.5°
C1C2H2109.5°109.4°
C1C2H3109.5°109.5°
C1C2H4109.5°109.5°
NC1C109.6°109.4°
C1NC3128.7°126.1°
NC1H1109.0°109.5°
CC1H1108.5°109.5°
C1CH21109.5°109.5°
C1CH22109.5°109.5°
C1CH23109.5°109.5°
NC3C4106.1°107.6°
NC3H5127.0°126.2°
C3C4N2131.2°126.1°
C4C3H5126.9°126.2°
C4N2C6122.4°120.0°
C4N2H19118.8°120.0°
N2C6C7114.5°120.0°
N2C6O122.2°120.1°
C6N2H19118.8°120.1°
C7C6O123.2°120.0°
C6C7C8114.6°109.5°
C6C7H6108.2°109.5°
C6C7H7108.2°109.4°
C14O1C13117.8°117.0°
O1C14H11109.5°109.5°
O1C14H12109.4°109.5°
O1C14H13109.5°109.5°
O1C13C8115.4°120.0°
O1C13C12123.7°120.0°
C7C8C13120.7°120.0°
C7C8C9121.1°120.0°
C8C7H6108.2°109.5°
C8C7H7108.2°109.5°
C8C13C12120.9°120.0°
C13C8C9118.3°120.0°
C13C12C11119.1°119.9°
C13C12H10120.5°120.0°
C8C9C10121.3°120.1°
C8C9H8119.3°119.9°
C12C11C10121.0°119.9°
C12C11O2120.7°120.0°
C11C12H10120.5°120.1°
C9C10C11119.4°120.1°
C10C9H8119.4°120.0°
C9C10H9120.3°120.0°
C10C11O2118.3°120.0°
C11C10H9120.3°120.0°
C11O2C15121.6°118.0°
C22N4C15115.5°121.5°
N4C22N3128.4°122.9°
N4C22H15115.8°118.5°
N4C15O2121.4°120.8°
N4C15C16124.5°118.3°
C22N3C21115.2°120.4°
N3C22H15115.8°118.6°
O2C15C16114.1°120.9°
C15C16C21113.8°118.2°
C15C16C17126.6°122.0°
N3C21C16122.6°118.7°
N3C21C20118.2°121.9°
C21C16C17119.6°119.8°
C16C21C20119.2°119.4°
C16C17C18120.1°119.6°
C16C17H27120.0°120.2°
C21C20C19120.5°119.6°
C21C20H14119.8°120.2°
C17C18C19120.3°120.7°
C17C18O4125.2°119.7°
C18C17H27120.0°120.2°
C20C19C18120.4°120.8°
C20C19O3125.0°119.6°
C19C20H14119.8°120.2°
C19C18O4114.5°119.6°
C18C19O3114.5°119.6°
C18O4C24118.3°117.0°
C19O3C23118.1°117.0°
O4C24H16109.5°109.4°
O4C24H17109.4°109.5°
O4C24H18109.5°109.5°
O3C23H24109.5°109.4°
O3C23H25109.5°109.5°
O3C23H26109.5°109.5°
H2C2H3109.5°109.4°
H2C2H4109.5°109.5°
H3C2H4109.5°109.5°
H6C7H7109.5°109.5°
H11C14H12109.5°109.4°
H11C14H13109.5°109.4°
H12C14H13109.5°109.5°
H16C24H17109.5°109.4°
H16C24H18109.4°109.5°
H17C24H18109.5°109.5°
H21CH22109.4°109.4°
H21CH23109.5°109.4°
H22CH23109.5°109.5°
H24C23H25109.5°109.4°
H24C23H26109.5°109.5°
H25C23H26109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
N1C5C4H20180.0°180.0°
C5N1NC1179.6°180.0°
C5N1NC30.1°0.4°
N1C5C4C30.2°0.0°
N1C5C4N2179.9°179.9°
NN1C5C40.1°0.3°
N1NC1C2129.9°145.0°
N1NC1C3179.5°179.5°
N1NC1C107.6°95.0°
N1NC3C40.2°0.4°
N1NC1H111.1°25.0°
N1NC3H5179.8°179.9°
NN1C5H20179.9°179.8°
C5C4C3N0.2°0.2°
C5C4C3N2179.8°179.9°
C5C4N2C6163.6°0.1°
C5C4C3H5179.8°180.0°
C5C4N2H1916.4°179.9°
C2C1NC122.5°119.9°
C2C1NH1118.8°120.1°
C2C1CH1119.2°120.0°
C2C1NC350.6°34.4°
C1C2H2H3120.0°119.9°
C1C2H2H4120.0°120.0°
C1C2H3H4120.0°120.1°
C2C1CH21180.0°180.0°
C2C1CH2260.0°60.0°
C2C1CH2360.0°60.0°
NC1CH1119.0°120.0°
C1NC3C4179.7°179.9°
NC1C2H2180.0°60.1°
NC1C2H360.0°180.0°
NC1C2H460.0°59.9°
C1NC3H50.3°0.3°
NC1CH2158.2°60.0°
NC1CH2261.8°60.0°
NC1CH23178.2°180.0°
CC1NC371.8°85.5°
CC1C2H258.4°180.0°
CC1C2H361.6°60.1°
CC1C2H4178.4°60.0°
C1CH21H22120.0°120.0°
C1CH21H23120.0°120.0°
C1CH22H23120.0°120.1°
NC3C4H5180.0°179.8°
NC3C4N2179.9°179.7°
C3NC1H1169.5°154.5°
C3C4N2C616.2°180.0°
C3C4N2H19163.8°0.1°
C3C4C5H20179.8°180.0°
C4N2C6H19180.0°180.0°
C4N2C6C7175.5°180.0°
C4N2C6O0.3°0.1°
N2C4C3H50.1°0.1°
N2C4C5H200.0°0.1°
N2C6C7O175.8°179.9°
N2C6C7C8171.2°180.0°
N2C6C7H650.5°59.9°
N2C6C7H768.0°60.0°
C6C7C8H6120.7°120.0°
C6C7C8H7120.8°119.9°
C6C7C8C13140.4°84.7°
C6C7C8C940.3°95.0°
C6C7H6H7117.7°119.9°
C7C6N2H194.5°0.0°
OC6C7C813.0°0.0°
OC6C7H6133.7°120.0°
OC6C7H7107.8°120.0°
OC6N2H19179.7°180.0°
C14O1C13C8172.0°180.0°
C14O1C13C127.7°0.3°
O1C14H11H12120.0°120.0°
O1C14H11H13120.0°120.0°
O1C14H12H13120.0°120.0°
O1C13C8C70.1°0.0°
O1C13C8C12179.8°179.7°
O1C13C8C9179.4°179.7°
O1C13C12C11180.0°179.7°
O1C13C12H100.0°0.0°
C13O1C14H11180.0°60.0°
C13O1C14H1260.0°60.0°
C13O1C14H1360.0°179.9°
C7C8C13C9179.3°179.7°
C7C8C13C12179.7°179.7°
C7C8C9C10179.9°179.9°
C8C7H6H7117.7°120.0°
C7C8C9H80.0°0.0°
C8C13C12C110.2°0.5°
C13C8C9C100.8°0.3°
C13C8C7H698.9°155.3°
C13C8C7H719.6°35.2°
C13C8C9H8179.3°179.8°
C8C13C12H10179.8°179.7°
C12C13C8C90.4°0.6°
C13C12C11H10180.0°179.7°
C13C12C11C100.5°0.3°
C13C12C11O2179.7°179.8°
C8C9C10H8180.0°179.9°
C8C9C10C110.5°0.0°
C9C8C7H680.4°25.0°
C9C8C7H7161.1°145.0°
C8C9C10H9179.5°180.0°
C12C11C10C90.1°0.0°
C12C11C10O2179.2°180.0°
C12C11O2C1562.1°109.2°
C12C11C10H9179.9°180.0°
C9C10C11H9180.0°180.0°
C9C10C11O2179.3°180.0°
C10C11O2C15118.6°70.8°
C11C10C9H8179.5°180.0°
C10C11C12H10179.5°180.0°
C11O2C15N40.0°6.1°
C11O2C15C16179.3°174.1°
O2C11C10H90.7°0.0°
O2C11C12H100.4°0.0°
N4C22N3H15180.0°179.3°
C22N4C15O2179.4°179.8°
C22N4C15C160.2°0.0°
N4C22N3C210.4°0.8°
C15N4C22N30.3°0.6°
N4C15O2C16179.3°179.8°
N4C15C16C210.6°0.2°
N4C15C16C17179.7°179.8°
C15N4C22H15179.7°179.8°
C22N3C21C160.1°0.5°
C22N3C21C20179.9°179.5°
O2C15C16C21179.8°180.0°
O2C15C16C171.0°0.0°
C15C16C21N30.5°0.0°
C15C16C21C17179.2°180.0°
C15C16C21C20179.7°180.0°
C15C16C17C18179.7°180.0°
C15C16C17H270.3°0.0°
N3C21C16C20179.8°180.0°
N3C21C16C17179.7°180.0°
N3C21C20C19180.0°180.0°
N3C21C20H140.0°0.0°
C21N3C22H15179.6°180.0°
C21C16C17C180.6°0.0°
C16C21C20C190.1°0.0°
C16C21C20H14179.9°180.0°
C21C16C17H27179.4°180.0°
C17C16C21C200.5°0.0°
C16C17C18H27180.0°180.0°
C16C17C18C190.3°0.0°
C16C17C18O4179.2°180.0°
C21C20C19H14180.0°180.0°
C21C20C19C180.1°0.0°
C21C20C19O3179.8°180.0°
C17C18C19C200.0°0.0°
C17C18C19O4179.6°180.0°
C17C18C19O3179.9°180.0°
C17C18O4C242.5°0.0°
C20C19C18O3179.9°180.0°
C20C19C18O4179.6°180.0°
C20C19O3C230.5°0.0°
C19C18O4C24177.1°180.0°
C18C19O3C23179.6°180.0°
C18C19C20H14179.9°180.0°
C19C18C17H27179.7°180.0°
O4C18C19O30.3°0.0°
C18O4C24H16180.0°60.0°
C18O4C24H1760.0°60.0°
C18O4C24H1860.0°180.0°
O4C18C17H270.8°0.0°
O3C19C20H140.2°0.0°
C19O3C23H24180.0°60.0°
C19O3C23H2560.0°59.9°
C19O3C23H2660.0°180.0°
O4C24H16H17120.0°120.0°
O4C24H16H18120.0°120.0°
O4C24H17H18120.0°120.0°
O3C23H24H25120.0°120.0°
O3C23H24H26120.0°120.0°
O3C23H25H26120.0°120.0°
H1C1C2H260.8°60.0°
H1C1C2H3179.2°59.9°
H1C1C2H459.2°180.0°
H1C1CH2160.8°60.0°
H1C1CH22179.3°180.0°
H1C1CH2359.2°60.0°
H2C2H3H4120.0°120.1°
H8C9C10H90.5°0.1°
H11C14H12H13120.0°120.0°
H16C24H17H18120.0°120.0°
H21CH22H23120.0°120.0°
H24C23H25H26120.0°120.0°

222415

PDB entries from 2024-07-10

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