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A1I5A

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C9C10doub1.38Å1.37ÅAromatic
C9C8sing1.38Å1.39ÅAromatic
C10C11sing1.38Å1.39ÅAromatic
C8C7doub1.38Å1.38ÅAromatic
C11C6doub1.38Å1.40ÅAromatic
C7C6sing1.38Å1.39ÅAromatic
C6C5sing1.51Å1.51Å
C5C4sing1.53Å1.49Å
C4C3sing1.53Å1.54Å
O1C12doub1.21Å1.26Å
C3C12sing1.51Å1.55Å
C3N1sing1.47Å1.46Å
C12O2sing1.34Å1.27Å
N1C2sing1.47Å1.51Å
C2C1sing1.53Å1.52Å
C2C13sing1.51Å1.53Å
O3C13doub1.21Å1.23Å
C13N2sing1.35Å1.36Å
N2C14sing1.47Å1.48Å
N2C22sing1.47Å1.46Å
C14C15sing1.51Å1.50Å
C22C23sing1.51Å1.54Å
C22C21sing1.53Å1.54Å
O4C23doub1.21Å1.23Å
C23O5sing1.34Å1.29Å
C15C16sing1.39Å1.38ÅAromatic
C15C20doub1.38Å1.39ÅAromatic
C16C17doub1.38Å1.40ÅAromatic
C21C20sing1.51Å1.51Å
C20C19sing1.39Å1.41ÅAromatic
C17C18sing1.38Å1.37ÅAromatic
C19C18doub1.38Å1.38ÅAromatic
C4H1sing1.09Å1.10Å
C4H2sing1.09Å1.10Å
C14H3sing1.09Å1.10Å
C14H4sing1.09Å1.10Å
C5H5sing1.09Å1.10Å
C5H6sing1.09Å1.10Å
C11H7sing1.08Å1.08Å
C7H8sing1.08Å1.08Å
C8H9sing1.08Å1.08Å
C9H10sing1.08Å1.08Å
C10H11sing1.08Å1.08Å
N1H12sing1.01Å1.00Å
C3H14sing1.09Å1.10Å
C1H15sing1.09Å1.10Å
C1H16sing1.09Å1.10Å
C1H17sing1.09Å1.10Å
C2H18sing1.09Å1.10Å
O2H19sing0.97Å0.95Å
C16H20sing1.08Å1.08Å
C17H21sing1.08Å1.08Å
C18H22sing1.08Å1.08Å
C19H23sing1.08Å1.08Å
C21H24sing1.09Å1.10Å
C21H25sing1.09Å1.10Å
C22H26sing1.09Å1.10Å
O5H27sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C10C9C8120.2°120.0°
C9C10C11120.3°120.0°
C10C9H10119.9°120.0°
C9C10H11119.8°120.1°
C9C8C7120.1°120.0°
C9C8H9119.9°120.0°
C8C9H10119.9°120.0°
C10C11C6119.7°120.0°
C10C11H7120.1°120.0°
C11C10H11119.8°120.0°
C8C7C6119.9°120.0°
C8C7H8120.1°120.0°
C7C8H9119.9°120.0°
C11C6C7119.6°120.0°
C11C6C5120.6°120.0°
C6C11H7120.1°120.0°
C7C6C5119.6°120.0°
C6C7H8120.0°120.0°
C6C5C4118.3°109.5°
C6C5H5107.2°109.4°
C6C5H6107.2°109.4°
C5C4C3111.3°109.4°
C5C4H1109.0°109.5°
C5C4H2109.0°109.5°
C4C5H5107.2°109.5°
C4C5H6107.3°109.5°
C4C3C12110.5°109.4°
C4C3N1111.3°109.5°
C3C4H1109.0°109.5°
C3C4H2109.0°109.5°
C4C3H14107.5°109.5°
O1C12C3117.1°120.0°
O1C12O2123.3°120.0°
C12C3N1111.4°109.5°
C3C12O2119.5°120.0°
C12C3H14107.4°109.4°
C3N1C2111.9°111.0°
C3N1H12108.9°111.0°
N1C3H14108.5°109.5°
C12O2H19109.5°117.0°
N1C2C1108.3°109.5°
N1C2C13110.7°109.5°
C2N1H12108.9°111.0°
N1C2H18109.4°109.5°
C1C2C13109.8°109.5°
C2C1H15109.5°109.4°
C2C1H16109.5°109.4°
C2C1H17109.5°109.4°
C1C2H18109.3°109.4°
C2C13O3120.2°120.0°
C2C13N2119.0°120.0°
C13C2H18109.2°109.5°
O3C13N2120.7°120.0°
C13N2C14125.5°121.3°
C13N2C22114.5°121.3°
C14N2C22119.8°117.4°
N2C14C15109.6°109.7°
N2C14H3109.4°109.5°
N2C14H4109.4°109.4°
N2C22C23112.7°109.7°
N2C22C21110.9°107.9°
N2C22H26109.7°109.7°
C14C15C16122.8°117.8°
C14C15C20117.2°122.3°
C15C14H3109.4°109.4°
C15C14H4109.5°109.4°
C23C22C21106.3°109.8°
C22C23O4119.0°120.0°
C22C23O5117.0°120.0°
C23C22H26108.6°109.8°
C22C21C20111.3°110.9°
C22C21H24109.0°109.2°
C22C21H25109.0°109.2°
C21C22H26108.6°109.8°
O4C23O5123.9°120.0°
C23O5H27109.5°117.0°
C16C15C20119.7°119.9°
C15C16C17119.8°120.5°
C15C16H20120.1°119.7°
C15C20C21116.4°122.9°
C15C20C19119.4°119.5°
C16C17C18121.6°119.7°
C17C16H20120.1°119.8°
C16C17H21119.2°120.1°
C21C20C19124.2°117.6°
C20C21H24109.0°109.2°
C20C21H25109.0°109.2°
C20C19C18120.7°120.6°
C20C19H23119.7°119.8°
C17C18C19118.8°119.9°
C18C17H21119.2°120.2°
C17C18H22120.6°120.0°
C19C18H22120.6°120.1°
C18C19H23119.7°119.7°
H1C4H2109.4°109.5°
H3C14H4109.5°109.4°
H5C5H6109.5°109.5°
H15C1H16109.5°109.5°
H15C1H17109.5°109.5°
H16C1H17109.5°109.5°
H24C21H25109.5°109.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C10C9C8H10180.0°179.9°
C9C10C11H11180.0°179.8°
C10C9C8C71.4°0.2°
C9C10C11C64.2°0.0°
C9C10C11H7175.8°179.9°
C10C9C8H9178.6°179.8°
C8C9C10C113.4°0.2°
C9C8C7H9180.0°179.9°
C9C8C7C60.2°0.0°
C9C8C7H8179.8°179.9°
C8C9C10H11176.6°180.0°
C10C11C6H7180.0°179.9°
C10C11C6C73.0°0.2°
C10C11C6C5178.2°180.0°
C11C10C9H10176.6°180.0°
C8C7C6C111.0°0.2°
C8C7C6H8180.0°179.9°
C8C7C6C5176.2°180.0°
C7C8C9H10178.6°179.9°
C11C6C7C5175.2°179.8°
C11C6C5C421.8°89.9°
C11C6C5H599.4°30.0°
C11C6C5H6143.1°150.0°
C11C6C7H8179.0°179.7°
C6C11C10H11175.8°179.8°
C7C6C5C4163.0°90.2°
C7C6C5H575.8°149.8°
C7C6C5H641.7°29.8°
C7C6C11H7177.0°179.7°
C6C7C8H9179.8°179.9°
C6C5C4H5121.2°119.9°
C6C5C4H6121.2°120.0°
C6C5C4C3178.0°180.0°
C6C5C4H157.7°60.0°
C6C5C4H261.7°60.1°
C6C5H5H6116.0°120.0°
C5C6C11H71.8°0.1°
C5C6C7H83.8°0.1°
C5C4C3H1120.3°120.0°
C5C4C3H2120.3°120.0°
C5C4C3C1264.2°175.0°
C5C4C3N1171.5°65.0°
C5C4H1H2119.2°120.0°
C4C5H5H6116.1°120.0°
C5C4C3H1452.7°55.1°
C4C3C12O174.9°120.0°
C4C3C12N1124.2°120.0°
C4C3C12H14117.0°120.0°
C4C3N1H14118.1°120.1°
C4C3C12O2108.7°60.0°
C4C3N1C2178.2°155.0°
C3C4H1H2119.2°120.0°
C3C4C5H560.8°60.1°
C3C4C5H656.8°60.0°
C4C3N1H1257.8°81.0°
O1C12C3O2176.4°180.0°
O1C12C3N149.3°0.0°
O1C12C3H14168.1°120.0°
O1C12O2H190.0°0.1°
C12C3N1H14118.1°120.0°
C12C3N1C254.4°85.0°
C12C3C4H156.1°55.0°
C12C3C4H2175.5°65.0°
C12C3N1H1266.0°39.0°
C3C12O2H19176.1°179.9°
N1C3C12O2127.1°180.0°
C3N1C2H12120.4°123.9°
C3N1C2C1171.1°85.0°
C3N1C2C1368.4°155.0°
N1C3C4H168.2°175.0°
N1C3C4H251.2°55.0°
C3N1C2H1852.0°35.0°
O2C12C3H148.3°60.0°
N1C2C1C13121.0°120.0°
N1C2C1H18119.2°120.0°
N1C2C13H18120.5°120.0°
N1C2C13O319.5°16.5°
N1C2C13N2157.2°163.5°
C2N1C3H1463.7°35.0°
N1C2C1H15180.0°68.8°
N1C2C1H1660.0°51.2°
N1C2C1H1760.0°171.2°
C1C2C13H18119.9°120.0°
C1C2C13O3100.1°103.6°
C1C2C13N283.2°76.5°
C1C2N1H1250.7°39.0°
C2C1H15H16120.0°119.9°
C2C1H15H17120.0°120.0°
C2C1H16H17120.0°120.0°
C2C13O3N2176.6°179.9°
C2C13N2C140.7°3.9°
C2C13N2C22174.6°176.1°
C13C2N1H12171.3°81.1°
C13C2C1H1559.0°171.2°
C13C2C1H16179.0°68.9°
C13C2C1H1761.0°51.1°
O3C13N2C14175.9°176.0°
O3C13N2C228.8°4.0°
O3C13C2H18140.1°136.5°
C13N2C14C22175.1°180.0°
C13N2C14C15128.6°135.6°
C13N2C22C2353.3°3.8°
C13N2C22C21172.3°115.8°
C13N2C14H3111.4°104.3°
C13N2C14H48.6°15.6°
N2C13C2H1836.6°43.5°
C13N2C22H2667.8°124.6°
N2C14C15H3120.0°120.1°
N2C14C15H4120.0°120.0°
C14N2C22C23122.3°176.2°
C14N2C22C213.3°64.2°
N2C14C15C16130.1°168.5°
N2C14C15C2043.0°11.6°
N2C14H3H4119.9°119.9°
C14N2C22H26116.6°55.4°
C22N2C14C1546.5°44.4°
N2C22C23C21121.7°118.5°
N2C22C23H26121.7°120.7°
N2C22C21H26120.5°119.6°
N2C22C23O432.6°67.9°
N2C22C23O5147.2°112.1°
N2C22C21C2043.4°47.4°
C22N2C14H373.5°75.7°
C22N2C14H4166.5°164.4°
N2C22C21H24163.6°167.8°
N2C22C21H2576.9°72.9°
C14C15C16C20172.9°180.0°
C14C15C16C17176.7°179.5°
C14C15C20C213.0°1.4°
C14C15C20C19175.4°179.2°
C15C14H3H4120.0°119.9°
C14C15C16H203.2°0.4°
C23C22C21H26116.7°120.8°
C22C23O4O5179.7°179.9°
C23C22C21C2079.4°167.0°
C23C22C21H2440.8°72.6°
C23C22C21H25160.3°46.7°
C22C23O5H27179.7°180.0°
C21C22C23O489.1°50.5°
C21C22C23O591.2°129.4°
C22C21C20C1547.9°20.1°
C22C21C20H24120.3°120.4°
C22C21C20H25120.3°120.3°
C22C21C20C19130.4°160.5°
C22C21H24H25119.1°119.3°
O4C23C22H26154.2°171.4°
O4C23O5H270.0°0.0°
O5C23C22H2625.5°8.6°
C15C16C17H20180.0°179.9°
C16C15C20C21176.4°178.6°
C16C15C20C192.1°0.8°
C15C16C17C182.2°0.0°
C16C15C14H3109.9°71.5°
C16C15C14H410.1°48.4°
C15C16C17H21177.8°180.0°
C20C15C16C173.8°0.5°
C15C20C21C19178.3°179.3°
C15C20C19C181.4°0.5°
C20C15C14H377.0°108.5°
C20C15C14H4163.0°131.6°
C20C15C16H20176.2°179.6°
C15C20C19H23178.7°179.5°
C15C20C21H24168.2°140.5°
C15C20C21H2572.3°100.2°
C16C17C18H21180.0°179.9°
C16C17C18C191.3°0.2°
C16C17C18H22178.8°179.7°
C21C20C19C18179.7°178.8°
C21C20C19H230.4°1.2°
C20C21H24H25119.2°119.3°
C20C21C22H26163.9°72.2°
C20C19C18C173.0°0.0°
C20C19C18H23180.0°180.0°
C20C19C18H22177.0°180.0°
C19C20C21H2410.1°40.2°
C19C20C21H25109.3°79.2°
C17C18C19H22180.0°180.0°
C18C17C16H20177.8°179.9°
C17C18C19H23177.0°179.9°
C19C18C17H21178.8°179.7°
H1C4C5H5179.0°60.0°
H1C4C5H663.5°180.0°
H1C4C3H14173.0°65.0°
H2C4C5H559.5°180.0°
H2C4C5H6177.0°59.9°
H2C4C3H1467.5°175.0°
H7C11C10H114.2°0.3°
H8C7C8H90.2°0.0°
H9C8C9H101.4°0.1°
H10C9C10H113.4°0.1°
H12N1C3H14175.9°158.9°
H12N1C2H1868.3°158.9°
H15C1H16H17120.0°120.1°
H15C1C2H1860.8°51.2°
H16C1C2H1859.2°171.1°
H17C1C2H18179.2°68.8°
H20C16C17H212.2°0.1°
H21C17C18H221.2°0.3°
H22C18C19H232.9°0.0°
H24C21C22H2675.8°48.2°
H25C21C22H2643.6°167.5°

251801

PDB entries from 2026-04-08

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