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A1H7Z

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CC1sing1.51Å1.48Å
C1Osing1.34Å1.34ÅAromatic
ONsing1.21Å1.42ÅAromatic
NC2doub1.31Å1.31ÅAromatic
C3C2sing1.48Å1.47Å
C3C4doub1.39Å1.40ÅAromatic
C4C5sing1.38Å1.39ÅAromatic
C6C5sing1.51Å1.51Å
N1C6sing1.47Å1.48Å
N1C7sing1.47Å1.47Å
C7C8sing1.53Å1.53Å
C8C9sing1.53Å1.53Å
C9C10sing1.53Å1.53Å
C10C11sing1.53Å1.53Å
C11N1sing1.47Å1.47Å
C5C12doub1.38Å1.38ÅAromatic
C12C13sing1.38Å1.38ÅAromatic
C13C14doub1.38Å1.39ÅAromatic
C14C3sing1.39Å1.40ÅAromatic
C15C14sing1.51Å1.51Å
C2C16sing1.47Å1.41ÅAromatic
C1C16doub1.37Å1.36ÅAromatic
C16C17sing1.48Å1.48Å
C17C18doub1.39Å1.39ÅAromatic
C18C19sing1.38Å1.38ÅAromatic
C19C20doub1.39Å1.39ÅAromatic
C20N2sing1.40Å1.40Å
N2C21sing1.35Å1.35Å
C21O1doub1.21Å1.23Å
C22C21sing1.51Å1.52Å
O2C22sing1.43Å1.45Å
C23O2sing1.36Å1.38Å
C20C23sing1.40Å1.41ÅAromatic
C24C23doub1.38Å1.38ÅAromatic
C17C24sing1.39Å1.39ÅAromatic
C7H7sing1.09Å1.10Å
C7H6sing1.09Å1.10Å
C8H9sing1.09Å1.10Å
C8H8sing1.09Å1.10Å
C9H11sing1.09Å1.10Å
C9H10sing1.09Å1.10Å
C10H13sing1.09Å1.10Å
C10H12sing1.09Å1.10Å
C11H15sing1.09Å1.10Å
C11H14sing1.09Å1.10Å
C12H16sing1.08Å1.08Å
C13H17sing1.08Å1.08Å
C15H18sing1.09Å1.10Å
C15H19sing1.09Å1.10Å
C15H20sing1.09Å1.10Å
C19H22sing1.08Å1.08Å
C22H24sing1.09Å1.10Å
C22H25sing1.09Å1.10Å
C24H26sing1.08Å1.08Å
N2H23sing0.97Å1.00Å
C18H21sing1.08Å1.08Å
CH2sing1.09Å1.10Å
CHsing1.09Å1.10Å
CH1sing1.09Å1.10Å
C4H3sing1.08Å1.08Å
C6H4sing1.09Å1.10Å
C6H5sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CC1O116.6°126.7°
CC1C16133.8°126.7°
C1CH2109.5°109.4°
C1CH109.5°109.4°
C1CH1109.5°109.5°
C1ON108.5°113.2°
OC1C16109.6°106.6°
ONC2105.7°111.9°
NC2C3121.8°127.4°
NC2C16111.6°105.2°
C2C3C4117.1°120.1°
C2C3C14123.1°120.1°
C3C2C16126.6°127.4°
C3C4C5121.6°119.9°
C4C3C14119.8°119.8°
C3C4H3119.2°120.0°
C4C5C6120.9°119.9°
C4C5C12118.1°120.2°
C5C4H3119.2°120.1°
C5C6N1112.1°109.5°
C6C5C12121.0°119.9°
C5C6H4108.8°109.4°
C5C6H5108.8°109.5°
C6N1C7111.6°111.0°
C6N1C11111.5°111.0°
N1C6H4108.8°109.5°
N1C6H5108.8°109.5°
N1C7C8111.1°109.5°
C7N1C11109.0°111.2°
N1C7H7109.1°109.5°
N1C7H6109.1°109.5°
C7C8C9111.2°109.3°
C8C7H7109.1°109.5°
C8C7H6109.0°109.5°
C7C8H9109.0°109.5°
C7C8H8109.0°109.5°
C8C9C10111.2°109.1°
C9C8H9109.0°109.5°
C9C8H8109.0°109.5°
C8C9H11109.1°109.5°
C8C9H10109.0°109.5°
C9C10C11110.9°109.3°
C10C9H11109.0°109.5°
C10C9H10109.1°109.5°
C9C10H13109.1°109.6°
C9C10H12109.1°109.5°
C10C11N1110.9°109.5°
C11C10H13109.1°109.5°
C11C10H12109.1°109.5°
C10C11H15109.1°109.5°
C10C11H14109.1°109.5°
N1C11H15109.1°109.5°
N1C11H14109.1°109.4°
C5C12C13121.0°120.2°
C5C12H16119.5°119.9°
C12C13C14121.9°120.2°
C13C12H16119.5°119.9°
C12C13H17119.1°120.0°
C13C14C3117.6°119.8°
C13C14C15119.1°120.1°
C14C13H17119.0°119.8°
C3C14C15123.3°120.1°
C14C15H18109.5°109.5°
C14C15H19109.5°109.5°
C14C15H20109.5°109.5°
C2C16C1104.7°103.0°
C2C16C17129.2°128.5°
C1C16C17126.1°128.5°
C16C17C18120.6°120.0°
C16C17C24119.6°120.0°
C17C18C19120.9°120.1°
C18C17C24119.8°120.0°
C17C18H21119.6°119.9°
C18C19C20119.5°120.0°
C18C19H22120.3°119.9°
C19C18H21119.6°120.0°
C19C20N2121.9°120.6°
C19C20C23119.7°120.2°
C20C19H22120.2°120.0°
C20N2C21120.9°119.0°
N2C20C23118.4°119.2°
C20N2H23119.6°120.5°
N2C21O1122.0°120.2°
N2C21C22117.1°119.7°
C21N2H23119.5°120.4°
O1C21C22120.9°120.1°
C21C22O2113.5°109.7°
C21C22H24108.5°109.5°
C21C22H25108.4°109.4°
C22O2C23112.5°116.7°
O2C22H24108.4°109.5°
O2C22H25108.5°109.4°
O2C23C20121.6°119.4°
O2C23C24117.7°120.6°
C20C23C24120.7°120.0°
C23C24C17119.5°119.8°
C23C24H26120.2°120.1°
C17C24H26120.3°120.1°
H7C7H6109.5°109.5°
H9C8H8109.5°109.5°
H11C9H10109.5°109.6°
H13C10H12109.4°109.5°
H15C11H14109.4°109.4°
H18C15H19109.5°109.5°
H18C15H20109.4°109.5°
H19C15H20109.5°109.5°
H24C22H25109.5°109.4°
H2CH109.4°109.4°
H2CH1109.5°109.5°
HCH1109.5°109.5°
H4C6H5109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CC1OC16179.9°179.7°
CC1ON179.8°179.7°
CC1C16C2179.5°179.7°
CC1C16C170.1°0.3°
C1CH2H120.0°119.9°
C1CH2H1120.0°120.0°
C1CHH1120.0°120.0°
C1ONC20.3°0.1°
OC1C16C20.4°0.0°
OC1C16C17179.8°180.0°
OC1CH20.0°0.1°
OC1CH120.0°120.0°
OC1CH1120.0°120.0°
ONC2C3179.3°180.0°
ONC2C160.6°0.1°
NOC1C160.1°0.0°
NC2C3C16178.5°179.9°
NC2C3C4120.6°180.0°
NC2C3C1459.2°0.2°
NC2C16C10.6°0.0°
NC2C16C17180.0°180.0°
C2C3C4C14179.8°179.8°
C2C3C4C5180.0°180.0°
C2C3C14C13179.7°180.0°
C2C3C14C150.0°0.0°
C3C2C16C1179.3°180.0°
C3C2C16C171.3°0.0°
C2C3C4H30.0°0.0°
C3C4C5H3180.0°180.0°
C3C4C5C6179.5°179.8°
C3C4C5C120.3°0.0°
C4C3C14C130.1°0.2°
C4C3C14C15179.8°179.7°
C4C3C2C1657.9°0.0°
C4C5C6C12179.8°179.8°
C4C5C6N194.9°90.2°
C4C5C12C130.2°0.3°
C5C4C3C140.1°0.3°
C4C5C12H16179.8°180.0°
C4C5C6H425.5°29.8°
C4C5C6H5144.7°149.7°
C5C6N1H4120.4°120.0°
C5C6N1H5120.4°120.0°
C5C6N1C771.3°65.8°
C5C6N1C11166.5°170.0°
C6C5C12C13179.6°180.0°
C6C5C12H160.4°0.2°
C6C5C4H30.5°0.3°
C5C6H4H5118.8°119.9°
C6N1C7C11123.6°124.1°
C6N1C7C8174.5°174.2°
C6N1C11C10173.3°174.2°
N1C6C5C1284.9°90.0°
C6N1C7H754.2°65.8°
C6N1C7H665.3°54.2°
C6N1C11H1553.1°54.1°
C6N1C11H1466.5°65.8°
N1C6H4H5118.8°120.0°
N1C7C8H7120.3°120.0°
N1C7C8H6120.2°120.0°
N1C7C8C955.7°59.2°
C7N1C11C1063.0°61.7°
N1C7H7H6119.2°120.0°
N1C7C8H964.5°60.8°
N1C7C8H8176.0°179.1°
C7N1C11H15176.8°178.2°
C7N1C11H1457.2°58.3°
C7N1C6H449.0°54.2°
C7N1C6H5168.2°174.2°
C7C8C9H9120.2°120.0°
C7C8C9H8120.2°119.9°
C7C8C9C1049.7°57.7°
C8C7N1C1161.9°61.7°
C8C7H7H6119.2°120.0°
C7C8H9H8119.2°120.1°
C7C8C9H11170.0°177.6°
C7C8C9H1070.6°62.2°
C8C9C10H11120.3°119.9°
C8C9C10H10120.3°119.9°
C8C9C10C1150.6°57.7°
C9C8C7H7176.0°60.8°
C9C8C7H664.5°179.2°
C9C8H9H8119.2°120.1°
C8C9H11H10119.2°120.1°
C8C9C10H1369.6°62.3°
C8C9C10H12170.8°177.6°
C9C10C11H13120.2°120.0°
C9C10C11H12120.2°119.9°
C9C10C11N157.8°59.2°
C10C9C8H970.6°62.3°
C10C9C8H8169.9°177.6°
C10C9H11H10119.2°120.2°
C9C10H13H12119.3°120.1°
C9C10C11H15178.0°179.2°
C9C10C11H1462.4°60.8°
C10C11N1H15120.2°120.1°
C10C11N1H14120.2°120.0°
C11C10C9H11170.9°177.5°
C11C10C9H1069.6°62.2°
C11C10H13H12119.4°120.1°
C10C11H15H14119.3°120.0°
C11N1C7H7177.8°58.3°
C11N1C7H658.3°178.3°
N1C11C10H1362.4°60.8°
N1C11C10H12178.0°179.1°
N1C11H15H14119.3°120.0°
C11N1C6H473.1°70.0°
C11N1C6H546.1°50.0°
C5C12C13H16180.0°179.8°
C5C12C13C140.0°0.3°
C5C12C13H17180.0°180.0°
C12C5C4H3179.7°180.0°
C12C5C6H4154.7°150.0°
C12C5C6H535.5°30.1°
C12C13C14H17180.0°179.7°
C12C13C14C30.1°0.1°
C12C13C14C15179.9°180.0°
C13C14C3C15179.8°180.0°
C14C13C12H16180.0°179.9°
C13C14C15H1889.9°90.0°
C13C14C15H19150.1°150.0°
C13C14C15H2030.1°30.0°
C14C3C2C16122.3°179.7°
C3C14C13H17179.9°179.8°
C3C14C15H1889.9°90.0°
C3C14C15H1930.1°30.0°
C3C14C15H20150.1°150.0°
C14C3C4H3179.9°179.7°
C15C14C13H170.1°0.3°
C14C15H18H19120.0°120.0°
C14C15H18H20120.0°120.0°
C14C15H19H20120.0°120.0°
C2C16C1C17179.4°180.0°
C2C16C17C18110.1°65.0°
C2C16C17C2470.4°115.5°
C1C16C17C1870.6°115.0°
C1C16C17C24108.9°64.5°
C16C1CH2179.9°179.7°
C16C1CH60.1°60.4°
C16C1CH159.9°59.7°
C16C17C18C24179.5°179.5°
C16C17C18C19179.5°179.9°
C16C17C24C23179.4°179.7°
C16C17C24H260.7°0.2°
C16C17C18H210.5°0.0°
C17C18C19H21180.0°179.9°
C17C18C19C200.4°0.1°
C18C17C24C230.1°0.8°
C17C18C19H22179.7°179.7°
C18C17C24H26179.9°179.7°
C18C19C20H22180.0°179.8°
C18C19C20N2178.9°179.7°
C18C19C20C230.9°0.2°
C19C18C17C240.1°0.6°
C19C20N2C23178.0°180.0°
C19C20N2C21162.0°164.4°
C19C20C23O2179.7°179.9°
C19C20C23C241.1°0.0°
C19C20N2H2318.0°15.5°
C20C19C18H21179.6°180.0°
C20N2C21H23180.0°179.9°
C20N2C21O1179.4°178.4°
C20N2C21C220.7°1.6°
N2C20C23O21.6°0.2°
N2C20C23C24179.2°179.9°
N2C20C19H221.1°0.0°
N2C21O1C22179.9°179.9°
N2C21C22O230.5°31.3°
C21N2C20C2316.0°15.6°
N2C21C22H2490.1°88.8°
N2C21C22H25151.1°151.3°
O1C21C22O2149.5°148.6°
O1C21C22H2490.0°91.3°
O1C21C22H2528.9°28.6°
O1C21N2H230.6°1.7°
C21C22O2H24120.6°120.1°
C21C22O2H25120.6°120.0°
C21C22O2C2345.7°46.4°
C21C22H24H25118.2°119.9°
C22C21N2H23179.3°178.3°
C22O2C23C2032.7°32.8°
C22O2C23C24148.1°147.1°
O2C22H24H25118.2°119.9°
O2C23C20C24179.2°179.9°
O2C23C24C17180.0°179.6°
C23O2C22H2474.9°73.7°
C23O2C22H25166.3°166.4°
O2C23C24H260.0°0.1°
C20C23C24C170.7°0.5°
C23C20C19H22179.1°180.0°
C20C23C24H26179.3°180.0°
C23C20N2H23164.0°164.5°
C23C24C17H26180.0°179.5°
C24C17C18H21180.0°179.5°
H7C7C8H955.7°179.2°
H7C7C8H863.8°59.1°
H6C7C8H9175.2°59.2°
H6C7C8H855.8°60.9°
H9C8C9H1149.7°57.6°
H9C8C9H10169.2°177.8°
H8C8C9H1169.8°62.5°
H8C8C9H1049.7°57.7°
H11C9C10H1350.7°57.6°
H11C9C10H1268.9°62.5°
H10C9C10H13170.1°177.8°
H10C9C10H1250.6°57.7°
H13C10C11H1557.8°59.3°
H13C10C11H14177.3°179.2°
H12C10C11H1561.7°60.8°
H12C10C11H1457.8°59.1°
H16C12C13H170.0°0.2°
H18C15H19H20120.0°120.0°
H22C19C18H210.4°0.2°
H2CHH1120.0°120.1°

227344

PDB entries from 2024-11-13

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