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2I7

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O3C3sing1.43Å1.44Å
O2C2sing1.43Å1.48Å
C3C2sing1.53Å1.46Å
C3C4sing1.53Å1.58Å
O4C6sing1.43Å1.38Å
C2C1sing1.53Å1.47Å
C4N1sing1.47Å1.49Å
C1O1sing1.43Å1.45Å
C1C5sing1.53Å1.58Å
N1C7sing1.47Å1.31Å
N1C5sing1.47Å1.48Å
C7C8sing1.51Å1.62Å
C5C6sing1.53Å1.56Å
C19C20doub1.39Å1.40ÅAromatic
C19N3sing1.32Å1.35ÅAromatic
C20C21sing1.39Å1.40ÅAromatic
C8C9doub1.38Å1.39ÅAromatic
C8C25sing1.38Å1.40ÅAromatic
C9C10sing1.38Å1.43ÅAromatic
N3C18doub1.33Å1.32ÅAromatic
C21N4doub1.32Å1.35ÅAromatic
C25C24doub1.38Å1.45ÅAromatic
C10C11sing1.51Å1.57Å
C10C23doub1.38Å1.38ÅAromatic
C11N2sing1.46Å1.47Å
C18N4sing1.33Å1.34ÅAromatic
C18C17sing1.48Å1.55Å
C22C17doub1.39Å1.40ÅAromatic
C22C12sing1.39Å1.42ÅAromatic
C24C23sing1.38Å1.38ÅAromatic
C17C16sing1.39Å1.39ÅAromatic
N2C12sing1.40Å1.49Å
C12C13doub1.39Å1.40ÅAromatic
C16C14doub1.38Å1.40ÅAromatic
C13C14sing1.38Å1.40ÅAromatic
C14C15sing1.51Å1.56Å
C4H2sing1.09Å1.10Å
C4H3sing1.09Å1.10Å
C5H4sing1.09Å1.10Å
C6H5sing1.09Å1.10Å
C6H6sing1.09Å1.10Å
C7H7sing1.09Å1.10Å
C7H8sing1.09Å1.10Å
C13H9sing1.08Å1.08Å
C15H10sing1.09Å1.10Å
C15H11sing1.09Å1.10Å
C15H12sing1.09Å1.10Å
C20H13sing1.08Å1.08Å
C21H14sing1.08Å1.08Å
C22H15sing1.08Å1.08Å
C24H16sing1.08Å1.08Å
C1H17sing1.09Å1.10Å
C11H18sing1.09Å1.10Å
C11H19sing1.09Å1.10Å
C16H20sing1.08Å1.08Å
C19H21sing1.08Å1.08Å
C2H22sing1.09Å1.10Å
C23H23sing1.08Å1.08Å
C25H24sing1.08Å1.08Å
C3H25sing1.09Å1.10Å
C9H26sing1.08Å1.08Å
N2H27sing0.97Å1.00Å
O1H28sing0.97Å0.95Å
O2H29sing0.97Å0.95Å
O3H30sing0.97Å0.95Å
O4H31sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O3C3C2109.8°109.5°
O3C3C4113.6°109.5°
O3C3H25109.0°109.6°
C3O3H30109.5°114.0°
O2C2C3103.6°109.6°
O2C2C1110.5°109.5°
O2C2H22110.9°109.5°
C2O2H29109.5°114.0°
C2C3C4108.6°109.2°
C3C2C1109.5°109.2°
C3C2H22111.1°109.5°
C2C3H25108.6°109.5°
C3C4N1110.4°109.6°
C3C4H2109.3°109.5°
C3C4H3109.2°109.5°
C4C3H25107.2°109.5°
O4C6C5107.4°109.4°
O4C6H5110.0°109.4°
O4C6H6110.0°109.5°
C6O4H31109.5°114.0°
C2C1O1110.1°109.5°
C2C1C5113.1°109.3°
C2C1H17106.7°109.5°
C1C2H22111.0°109.6°
C4N1C7111.0°111.0°
C4N1C5107.3°111.2°
N1C4H2109.2°109.5°
N1C4H3109.3°109.5°
O1C1C5113.9°109.5°
O1C1H17107.0°109.5°
C1O1H28109.5°114.0°
C1C5N1108.9°109.5°
C1C5C6107.1°109.5°
C1C5H4110.1°109.4°
C5C1H17105.5°109.5°
C7N1C5120.4°111.0°
N1C7C8112.0°109.4°
N1C7H7108.8°109.5°
N1C7H8108.8°109.4°
N1C5C6108.8°109.4°
N1C5H4111.4°109.5°
C7C8C9122.3°120.0°
C7C8C25120.4°120.0°
C8C7H7108.8°109.5°
C8C7H8108.8°109.5°
C6C5H4110.4°109.5°
C5C6H5110.0°109.5°
C5C6H6110.0°109.4°
C20C19N3118.0°119.2°
C19C20C21117.7°118.6°
C19C20H13121.1°120.7°
C20C19H21121.0°120.5°
C19N3C18122.8°120.8°
N3C19H21121.0°120.4°
C20C21N4120.9°119.2°
C21C20H13121.2°120.7°
C20C21H14119.5°120.4°
C9C8C25117.1°120.0°
C8C9C10122.4°120.0°
C8C9H26118.8°120.0°
C8C25C24120.6°120.0°
C8C25H24119.7°120.0°
C9C10C11118.4°120.0°
C9C10C23119.8°120.0°
C10C9H26118.8°120.0°
N3C18N4121.0°121.6°
N3C18C17118.9°119.2°
C21N4C18119.5°120.7°
N4C21H14119.5°120.4°
C25C24C23120.8°120.0°
C25C24H16119.6°120.0°
C24C25H24119.7°120.0°
C11C10C23121.8°120.0°
C10C11N2112.0°109.5°
C10C11H18108.8°109.5°
C10C11H19108.8°109.5°
C10C23C24119.2°120.0°
C10C23H23120.4°120.0°
C11N2C12119.8°120.0°
N2C11H18108.8°109.5°
N2C11H19108.8°109.5°
C11N2H27106.9°120.0°
N4C18C17120.1°119.2°
C18C17C22120.0°120.1°
C18C17C16119.2°120.1°
C17C22C12119.0°119.8°
C22C17C16120.8°119.8°
C17C22H15120.5°120.1°
C22C12N2119.1°120.0°
C22C12C13119.8°120.0°
C12C22H15120.5°120.1°
C23C24H16119.6°120.0°
C24C23H23120.4°120.0°
C17C16C14120.4°120.1°
C17C16H20119.8°120.0°
N2C12C13121.1°120.0°
C12N2H27106.8°120.0°
C12C13C14120.5°120.2°
C12C13H9119.7°119.9°
C16C14C13119.4°120.2°
C16C14C15119.2°119.9°
C14C16H20119.8°120.0°
C13C14C15121.4°119.9°
C14C13H9119.7°119.9°
C14C15H10109.5°109.5°
C14C15H11109.5°109.5°
C14C15H12109.5°109.5°
H2C4H3109.5°109.4°
H5C6H6109.5°109.5°
H7C7H8109.5°109.5°
H10C15H11109.5°109.5°
H10C15H12109.5°109.4°
H11C15H12109.5°109.5°
H18C11H19109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O3C3C2O259.6°62.5°
O3C3C2C4124.7°119.9°
O3C3C2H25119.1°120.2°
O3C3C4H25120.4°120.2°
O3C3C2C1177.4°177.6°
O3C3C4N1174.4°179.1°
O3C3C4H254.3°59.0°
O3C3C4H365.4°60.9°
O3C3C2H2259.6°57.6°
O2C2C3C1117.9°119.9°
O2C2C3H22119.1°120.1°
O2C2C3C4175.7°177.6°
O2C2C1H22123.4°120.1°
O2C2C1O160.8°62.4°
O2C2C1C5170.5°177.6°
O2C2C1H1754.9°57.7°
O2C2C3H2559.5°57.7°
C2C3C4H25117.1°119.9°
C3C2C1H22123.1°120.0°
C2C3C4N163.1°59.2°
C3C2C1O1174.3°177.6°
C3C2C1C557.0°57.7°
C2C3C4H2176.7°60.9°
C2C3C4H357.0°179.2°
C3C2C1H1758.6°62.3°
C3C2O2H29180.0°60.3°
C2C3O3H30180.0°180.0°
C4C3C2C157.9°57.6°
C3C4N1H2120.1°120.1°
C3C4N1H3120.1°120.0°
C3C4N1C7163.4°174.2°
C3C4N1C563.2°61.8°
C3C4H2H3119.6°119.9°
C4C3C2H2265.1°62.3°
C4C3O3H3058.2°60.2°
O4C6C5C173.9°56.6°
O4C6C5N143.6°63.4°
O4C6C5H5119.7°120.0°
O4C6C5H6119.7°120.0°
O4C6C5H4166.2°176.6°
O4C6H5H6120.9°120.0°
C2C1O1C5128.2°119.8°
C2C1O1H17115.6°120.1°
C2C1C5H17116.3°120.0°
C2C1C5N157.4°59.2°
C2C1C5C6174.9°179.2°
C2C1C5H465.0°60.8°
C1C2C3H2558.3°62.2°
C2C1O1H28180.0°60.2°
C1C2O2H2962.8°180.0°
C4N1C5C158.6°61.8°
C4N1C7C5126.5°124.1°
C4N1C7C860.9°62.5°
C4N1C5C6175.0°178.2°
N1C4H2H3119.6°119.9°
C4N1C5H463.1°58.2°
C4N1C7H7178.7°57.6°
C4N1C7H859.4°177.6°
N1C4C3H2554.0°60.7°
O1C1C5H17117.0°120.1°
O1C1C5N1175.9°179.1°
O1C1C5C658.4°60.9°
O1C1C5H461.6°59.1°
O1C1C2H2262.6°57.6°
C1C5N1C7173.2°174.2°
C1C5N1C6116.4°120.0°
C1C5N1H4121.6°120.0°
C1C5C6H4119.9°120.0°
C1C5C6H545.7°176.6°
C1C5C6H6166.4°63.4°
C5C1C2H2266.1°62.3°
C5C1O1H2851.7°180.0°
N1C7C8H7120.4°120.1°
N1C7C8H8120.4°119.9°
C7N1C5C656.8°54.2°
N1C7C8C986.4°90.1°
N1C7C8C2588.8°89.7°
C7N1C4H243.2°65.8°
C7N1C4H376.5°54.1°
C7N1C5H465.1°65.8°
N1C7H7H8118.8°120.0°
C5N1C7C865.6°173.4°
N1C5C6H4122.6°120.0°
C5N1C4H2176.7°58.3°
C5N1C4H357.0°178.2°
N1C5C6H5163.2°56.5°
N1C5C6H676.1°176.6°
C5N1C7H754.8°66.6°
C5N1C7H8174.0°53.4°
N1C5C1H1758.9°60.8°
C7C8C9C25175.4°179.8°
C7C8C9C10176.9°180.0°
C7C8C25C24178.6°180.0°
C8C7H7H8118.8°120.0°
C7C8C25H241.4°0.0°
C7C8C9H263.1°0.1°
C5C6H5H6121.0°120.0°
C6C5C1H1758.6°59.2°
C5C6O4H31180.0°179.9°
C20C19N3H21180.0°180.0°
C19C20C21H13180.0°180.0°
C20C19N3C181.7°0.0°
C19C20C21N40.7°0.0°
C19C20C21H14179.3°180.0°
N3C19C20C210.9°0.0°
C19N3C18N40.9°0.0°
C19N3C18C17178.0°180.0°
N3C19C20H13179.1°180.0°
C20C21N4H14180.0°180.0°
C20C21N4C181.6°0.0°
C21C20C19H21179.1°180.0°
C8C9C10H26180.0°179.8°
C9C8C25C243.1°0.2°
C8C9C10C11179.4°179.9°
C8C9C10C230.9°0.1°
C9C8C7H7153.2°30.0°
C9C8C7H834.0°150.0°
C9C8C25H24176.9°179.8°
C25C8C9C101.5°0.2°
C8C25C24H24180.0°179.9°
C8C25C24C234.2°0.0°
C25C8C7H731.6°150.2°
C25C8C7H8150.8°30.2°
C8C25C24H16175.7°179.8°
C25C8C9H26178.5°179.7°
C9C10C11C23178.5°179.9°
C9C10C11N2160.1°90.1°
C9C10C23C241.8°0.4°
C9C10C11H1839.7°30.0°
C9C10C11H1979.5°149.9°
C9C10C23H23178.2°179.9°
N3C18N4C210.8°0.0°
N3C18N4C17178.9°180.0°
N3C18C17C2230.4°179.6°
N3C18C17C16148.1°0.1°
C18N3C19H21178.2°180.0°
C21N4C18C17179.7°180.0°
N4C21C20H13179.3°180.0°
C25C24C23C103.5°0.3°
C25C24C23H16180.0°179.7°
C25C24C23H23176.5°180.0°
C10C11N2H18120.4°120.0°
C10C11N2H19120.4°120.0°
C11C10C23C24179.7°179.7°
C10C11N2C1262.8°180.0°
C10C11H18H19118.9°120.0°
C11C10C23H230.3°0.0°
C11C10C9H260.6°0.1°
C10C11N2H27175.7°0.0°
C23C10C11N221.4°90.0°
C10C23C24H23180.0°179.7°
C10C23C24H16176.5°179.9°
C23C10C11H18141.8°149.9°
C23C10C11H1998.9°30.0°
C23C10C9H26179.1°180.0°
C11N2C12C2220.2°0.0°
C11N2C12H27121.5°180.0°
C11N2C12C13158.8°180.0°
N2C11H18H19118.9°120.0°
N4C18C17C22150.7°0.5°
N4C18C17C1630.8°180.0°
C18N4C21H14178.5°180.0°
C18C17C22C16178.5°179.5°
C18C17C22C12178.5°179.7°
C18C17C16C14178.9°180.0°
C18C17C22H151.4°0.5°
C18C17C16H201.1°0.5°
C17C22C12H15180.0°179.2°
C17C22C12N2178.9°179.4°
C17C22C12C130.0°0.5°
C22C17C16C140.4°0.5°
C22C17C16H20179.6°180.0°
C12C22C17C160.1°0.8°
C22C12N2C13179.0°180.0°
C22C12C13C140.3°0.0°
C22C12C13H9179.7°179.7°
C22C12N2H27101.3°180.0°
C23C24C25H24175.8°179.9°
C17C16C14H20180.0°179.5°
C17C16C14C130.6°0.0°
C17C16C14C15179.8°180.0°
C16C17C22H15179.9°180.0°
N2C12C13C14178.6°180.0°
N2C12C13H91.3°0.3°
N2C12C22H151.1°0.2°
C12N2C11H1857.5°60.0°
C12N2C11H19176.8°60.0°
C12C13C14C160.6°0.3°
C12C13C14H9180.0°179.7°
C12C13C14C15179.8°179.8°
C13C12C22H15179.9°179.8°
C13C12N2H2779.8°0.0°
C16C14C13C15179.6°180.0°
C16C14C13H9179.4°180.0°
C16C14C15H1089.8°90.0°
C16C14C15H11150.2°30.0°
C16C14C15H1230.2°150.0°
C13C14C15H1089.8°90.0°
C13C14C15H1130.2°150.0°
C13C14C15H12150.2°30.0°
C13C14C16H20179.4°179.4°
C15C14C13H90.2°0.0°
C14C15H10H11120.0°120.0°
C14C15H10H12120.0°120.0°
C14C15H11H12120.0°120.0°
C15C14C16H200.2°0.5°
H2C4C3H2566.1°179.2°
H3C4C3H25174.1°59.3°
H4C5C6H574.1°63.5°
H4C5C6H646.5°56.6°
H4C5C1H17178.7°179.2°
H5C6O4H3160.3°60.1°
H6C6O4H3160.3°60.0°
H10C15H11H12120.0°120.0°
H13C20C21H140.7°0.1°
H13C20C19H210.9°0.0°
H16C24C23H233.5°0.3°
H16C24C25H244.2°0.2°
H17C1C2H22178.4°177.8°
H17C1O1H2864.5°59.9°
H18C11N2H2763.9°120.0°
H19C11N2H2755.4°120.0°
H22C2C3H25178.7°177.8°
H22C2O2H2960.7°59.9°
H25C3O3H3061.1°59.9°

225946

PDB entries from 2024-10-09

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