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EBW

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.51Å1.50Å
C1C5sing1.51Å1.51Å
C1O1doub1.21Å1.23Å
C2C6sing1.53Å1.52Å
C2H22sing1.09Å1.12Å
C2H21sing1.09Å1.11Å
C5C13sing1.53Å1.51Å
C5H52sing1.09Å1.11Å
C5H51sing1.09Å1.11Å
C6C7sing1.51Å1.53Å
C6H62sing1.09Å1.11Å
C6H61sing1.09Å1.12Å
C7C8doub1.38Å1.40ÅAromatic
C7C12sing1.38Å1.41ÅAromatic
C8C9sing1.38Å1.39ÅAromatic
C8H8sing1.08Å1.10Å
C9C10doub1.38Å1.40ÅAromatic
C9H9sing1.08Å1.10Å
C10C11sing1.38Å1.42ÅAromatic
C10N2sing1.40Å1.53Å
C11C12doub1.38Å1.41ÅAromatic
C11H11sing1.08Å1.10Å
N1C17sing1.40Å1.51Å
N1C20sing1.47Å1.50Å
N1C21sing1.47Å1.49Å
N1C22sing1.47Å1.50Å
N2C24sing1.47Å1.51Å
N2C25sing1.47Å1.50Å
N2C26sing1.47Å1.48Å
C12H12sing1.08Å1.10Å
C13C14sing1.51Å1.50Å
C13H132sing1.09Å1.12Å
C13H131sing1.09Å1.12Å
C14C15doub1.38Å1.40ÅAromatic
C14C19sing1.38Å1.38ÅAromatic
C15C16sing1.38Å1.39ÅAromatic
C15H15sing1.08Å1.10Å
C16C17doub1.38Å1.41ÅAromatic
C16H16sing1.08Å1.10Å
C17C18sing1.38Å1.40ÅAromatic
C18C19doub1.38Å1.39ÅAromatic
C18H18sing1.08Å1.10Å
C19H19sing1.08Å1.10Å
C20H203sing1.09Å1.12Å
C20H202sing1.09Å1.11Å
C20H201sing1.09Å1.12Å
C21H213sing1.09Å1.12Å
C21H212sing1.09Å1.12Å
C21H211sing1.09Å1.11Å
C22C23sing1.51Å1.50Å
C22H222sing1.09Å1.11Å
C22H221sing1.09Å1.12Å
C23C29doub1.31Å1.33Å
C23H23sing1.08Å1.10Å
C24C27sing1.51Å1.51Å
C24H242sing1.09Å1.11Å
C24H241sing1.09Å1.11Å
C25H253sing1.09Å1.11Å
C25H252sing1.09Å1.12Å
C25H251sing1.09Å1.11Å
C26H263sing1.09Å1.11Å
C26H262sing1.09Å1.11Å
C26H261sing1.09Å1.12Å
C27C28doub1.31Å1.34Å
C27H27sing1.08Å1.10Å
C28H282sing1.08Å1.10Å
C28H281sing1.08Å1.10Å
C29H292sing1.08Å1.10Å
C29H291sing1.08Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C5117.2°120.0°
C2C1O1120.7°120.0°
C1C2C6112.4°109.5°
C1C2H22111.1°109.5°
C1C2H21111.1°109.5°
C5C1O1121.7°120.0°
C1C5C13112.7°109.5°
C1C5H52111.0°109.5°
C1C5H51111.0°109.5°
C6C2H22111.1°109.4°
C6C2H21111.2°109.5°
C2C6C7114.9°109.5°
C2C6H62110.2°109.5°
C2C6H61110.2°109.5°
H22C2H2199.3°109.5°
C13C5H52111.0°109.4°
C13C5H51111.0°109.5°
C5C13C14111.3°109.5°
C5C13H132111.6°109.5°
C5C13H131111.6°109.5°
H52C5H5199.4°109.4°
C7C6H62110.2°109.4°
C7C6H61110.2°109.5°
C6C7C8119.1°120.0°
C6C7C12121.9°120.0°
H62C6H61100.1°109.4°
C8C7C12118.5°120.0°
C7C8C9121.3°120.0°
C7C8H8119.5°120.0°
C7C12C11120.4°120.0°
C7C12H12119.8°120.0°
C9C8H8119.2°120.0°
C8C9C10121.2°120.0°
C8C9H9119.0°120.0°
C10C9H9119.8°120.0°
C9C10C11117.7°120.0°
C9C10N2120.7°120.0°
C11C10N2121.6°120.0°
C10C11C12120.8°120.0°
C10C11H11120.1°120.0°
C10N2C24110.8°109.5°
C10N2C25111.0°109.5°
C10N2C26109.5°109.5°
C12C11H11119.2°120.0°
C11C12H12119.8°120.0°
C17N1C20111.1°109.5°
C17N1C21109.7°109.5°
C17N1C22109.4°109.4°
N1C17C16121.2°120.0°
N1C17C18120.9°120.0°
C20N1C21107.9°109.5°
C20N1C22109.6°109.4°
N1C20H203111.1°109.5°
N1C20H202111.6°109.5°
N1C20H201111.6°109.4°
C21N1C22109.1°109.5°
N1C21H213109.7°109.5°
N1C21H212112.1°109.4°
N1C21H211112.1°109.5°
N1C22C23114.9°109.5°
N1C22H222110.2°109.5°
N1C22H221110.2°109.5°
C24N2C25108.8°109.5°
C24N2C26108.2°109.4°
N2C24C27114.2°109.5°
N2C24H242110.5°109.5°
N2C24H241110.5°109.4°
C25N2C26108.5°109.5°
N2C25H253111.0°109.4°
N2C25H252111.7°109.5°
N2C25H251111.7°109.5°
N2C26H263109.5°109.4°
N2C26H262112.2°109.5°
N2C26H261112.2°109.5°
C14C13H132111.5°109.5°
C14C13H131111.6°109.5°
C13C14C15121.1°120.0°
C13C14C19120.1°120.0°
H132C13H13198.8°109.5°
C15C14C19118.8°120.0°
C14C15C16120.5°120.0°
C14C15H15119.9°120.0°
C14C19C18120.9°120.0°
C14C19H19119.4°120.0°
C16C15H15119.5°120.0°
C15C16C17120.7°120.0°
C15C16H16119.2°120.1°
C17C16H16120.1°120.0°
C16C17C18117.9°120.0°
C17C18C19121.1°120.0°
C17C18H18119.8°119.9°
C19C18H18119.1°120.0°
C18C19H19119.6°120.0°
H203C20H202111.6°109.5°
H203C20H201111.6°109.5°
H202C20H20198.7°109.5°
H213C21H212112.1°109.5°
H213C21H211112.2°109.5°
H212C21H21198.3°109.4°
C23C22H222110.2°109.5°
C23C22H221110.2°109.5°
C22C23C29120.8°120.0°
C22C23H23125.7°120.0°
H222C22H221100.1°109.4°
C29C23H23113.4°120.0°
C23C29H292113.4°120.0°
C23C29H291120.8°120.0°
C27C24H242110.5°109.5°
C27C24H241110.5°109.5°
C24C27C28122.2°120.0°
C24C27H27125.0°120.0°
H242C24H24199.8°109.5°
H253C25H252111.6°109.5°
H253C25H251111.7°109.4°
H252C25H25198.7°109.5°
H263C26H262112.3°109.4°
H263C26H261112.2°109.4°
H262C26H26198.2°109.6°
C28C27H27112.7°120.0°
C27C28H282112.7°120.0°
C27C28H281122.2°120.0°
H282C28H281125.1°120.0°
H292C29H291125.8°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C5O1172.8°180.0°
C1C2C6H22125.2°120.0°
C1C2C6H21125.2°120.0°
C1C2H22H21117.0°120.0°
C2C1C5C13155.3°180.0°
C2C1C5H5279.4°60.0°
C2C1C5H5130.1°60.0°
C1C2C6C772.7°180.0°
C1C2C6H62162.1°60.0°
C1C2C6H6152.5°60.0°
C5C1C2C684.4°180.0°
C5C1C2H22150.4°60.0°
C5C1C2H2140.8°60.0°
C1C5C13H52125.3°120.0°
C1C5C13H51125.2°120.0°
C1C5H52H51116.9°120.0°
C1C5C13C14179.0°180.0°
C1C5C13H13253.7°60.0°
C1C5C13H13155.7°60.0°
O1C1C2C6102.8°0.0°
O1C1C2H2222.5°120.0°
O1C1C2H21132.0°120.0°
O1C1C5C1317.4°0.0°
O1C1C5H52107.8°120.0°
O1C1C5H51142.6°120.0°
C6C2H22H21117.1°120.0°
C2C6C7H62125.2°120.0°
C2C6C7H61125.2°120.1°
C2C6H62H61116.1°120.0°
C2C6C7C880.5°90.0°
C2C6C7C12107.1°90.2°
H22C2C6C752.5°60.0°
H22C2C6H6272.7°180.0°
H22C2C6H61177.7°60.1°
H21C2C6C7162.1°60.0°
H21C2C6H6236.8°60.0°
H21C2C6H6172.7°180.0°
C13C5H52H51116.9°120.0°
C5C13C14H132125.3°120.0°
C5C13C14H131125.3°120.0°
C5C13H132H131117.4°120.0°
C5C13C14C1573.3°90.0°
C5C13C14C19105.3°90.0°
H52C5C13C1455.7°60.0°
H52C5C13H132179.0°180.0°
H52C5C13H13169.6°60.0°
H51C5C13C1453.8°60.0°
H51C5C13H13271.5°60.0°
H51C5C13H131179.1°179.9°
C7C6H62H61116.1°120.0°
C6C7C8C12172.7°179.8°
C6C7C8C9172.0°180.0°
C6C7C8H88.0°0.0°
C6C7C12C11171.9°179.8°
C6C7C12H128.1°0.2°
H62C6C7C844.7°150.0°
H62C6C7C12127.7°29.8°
H61C6C7C8154.3°30.1°
H61C6C7C1218.1°149.7°
C7C8C9H8180.0°180.0°
C7C8C9C100.5°0.0°
C7C8C9H9179.5°179.9°
C8C7C12C110.6°0.5°
C8C7C12H12179.4°180.0°
C12C7C8C90.6°0.2°
C12C7C8H8179.3°179.8°
C7C12C11C100.6°0.5°
C7C12C11H12180.0°179.6°
C7C12C11H11179.4°179.8°
C8C9C10H9180.0°179.9°
C8C9C10C111.6°0.0°
C8C9C10N2176.6°179.9°
H8C8C9C10179.5°180.0°
H8C8C9H90.5°0.1°
C9C10C11N2178.3°179.9°
C9C10C11C121.7°0.2°
C9C10C11H11178.3°180.0°
C9C10N2C24106.7°180.0°
C9C10N2C2514.3°60.0°
C9C10N2C26134.1°60.0°
H9C9C10C11178.3°179.9°
H9C9C10N23.4°0.0°
C10C11C12H11180.0°179.7°
C11C10N2C2471.5°0.1°
C11C10N2C25167.5°120.0°
C11C10N2C2647.7°120.0°
C10C11C12H12179.4°180.0°
N2C10C11C12176.6°179.8°
N2C10C11H113.4°0.1°
C10N2C24C25122.3°120.0°
C10N2C24C26120.0°120.0°
C10N2C25C26120.3°120.0°
C10N2C24C2761.1°180.0°
C10N2C24H24264.2°60.0°
C10N2C24H241173.7°60.0°
C10N2C25H253180.0°60.0°
C10N2C25H25254.8°180.0°
C10N2C25H25154.7°59.9°
C10N2C26H263179.9°60.0°
C10N2C26H26254.7°180.0°
C10N2C26H26154.7°59.9°
H11C11C12H120.6°0.2°
C17N1C20C21120.3°120.1°
C17N1C20C22121.0°120.0°
C17N1C21C22119.8°120.0°
N1C17C16C15179.0°180.0°
N1C17C16C18179.1°179.7°
N1C17C16H161.0°0.1°
N1C17C18C19179.1°179.8°
N1C17C18H181.0°0.2°
C17N1C20H203180.0°180.0°
C17N1C20H20254.7°59.9°
C17N1C20H20154.7°60.0°
C17N1C21H213180.0°60.0°
C17N1C21H21254.8°60.0°
C17N1C21H21154.7°180.0°
C17N1C22C2359.8°180.0°
C17N1C22H222174.9°60.0°
C17N1C22H22165.4°60.0°
C20N1C21C22119.0°120.0°
C20N1C17C16170.2°60.1°
C20N1C17C1810.7°120.2°
N1C20H203H202125.3°120.1°
N1C20H203H201125.2°119.9°
N1C20H202H201117.5°119.9°
C20N1C21H21358.8°60.1°
C20N1C21H21266.4°180.0°
C20N1C21H211175.9°60.0°
C20N1C22C2362.2°60.0°
C20N1C22H22263.0°180.0°
C20N1C22H221172.5°60.0°
C21N1C17C1651.0°60.0°
C21N1C17C18129.9°119.7°
C21N1C20H20359.7°59.9°
C21N1C20H202175.0°180.0°
C21N1C20H20165.5°60.0°
N1C21H213H212125.3°120.0°
N1C21H213H211125.3°120.1°
N1C21H212H211118.0°120.0°
C21N1C22C23179.8°60.0°
C21N1C22H22254.9°60.0°
C21N1C22H22154.6°180.0°
C22N1C17C1668.6°180.0°
C22N1C17C18110.4°0.3°
C22N1C20H20359.0°60.1°
C22N1C20H20266.3°60.0°
C22N1C20H201175.8°180.0°
C22N1C21H21360.2°180.0°
C22N1C21H212174.6°60.0°
C22N1C21H21165.1°60.0°
N1C22C23H222125.2°120.0°
N1C22C23H221125.2°120.1°
N1C22H222H221116.0°120.0°
N1C22C23C29121.2°125.0°
N1C22C23H2358.8°55.0°
C24N2C25C26117.5°120.0°
N2C24C27H242125.2°120.0°
N2C24C27H241125.2°119.9°
N2C24H242H241116.3°120.0°
C24N2C25H25357.9°60.0°
C24N2C25H252176.9°60.0°
C24N2C25H25167.4°180.0°
C24N2C26H26359.2°180.0°
C24N2C26H26266.1°60.1°
C24N2C26H261175.6°60.1°
N2C24C27C28136.2°125.0°
N2C24C27H2743.8°55.0°
C25N2C24C2761.2°60.0°
C25N2C24H242173.6°60.0°
C25N2C24H24164.1°180.0°
N2C25H253H252125.3°120.0°
N2C25H253H251125.3°120.0°
N2C25H252H251117.6°120.0°
C25N2C26H26358.7°60.0°
C25N2C26H262175.9°59.9°
C25N2C26H26166.5°179.9°
C26N2C24C27178.9°60.0°
C26N2C24H24255.9°180.0°
C26N2C24H24153.6°60.0°
C26N2C25H25359.6°180.0°
C26N2C25H25265.6°60.0°
C26N2C25H251175.1°60.1°
N2C26H263H262125.3°120.0°
N2C26H263H261125.2°120.0°
N2C26H262H261118.1°120.1°
C14C13H132H131117.4°120.0°
C13C14C15C19178.7°180.0°
C13C14C15C16178.5°180.0°
C13C14C15H151.5°0.1°
C13C14C19C18178.5°179.8°
C13C14C19H191.6°0.0°
H132C13C14C15161.4°30.0°
H132C13C14C1920.0°150.0°
H131C13C14C1551.9°150.0°
H131C13C14C19129.4°30.0°
C14C15C16H15180.0°180.0°
C14C15C16C170.0°0.1°
C14C15C16H16180.0°180.0°
C15C14C19C180.2°0.2°
C15C14C19H19179.8°180.0°
C19C14C15C160.1°0.0°
C19C14C15H15179.8°180.0°
C14C19C18C170.1°0.4°
C14C19C18H19180.0°179.9°
C14C19C18H18179.9°180.0°
C15C16C17H16180.0°179.9°
C15C16C17C180.0°0.3°
H15C15C16C17179.9°180.0°
H15C15C16H160.0°0.0°
C16C17C18C190.0°0.5°
C16C17C18H18180.0°179.9°
H16C16C17C18179.9°179.8°
C17C18C19H18180.0°179.6°
C17C18C19H19179.8°179.7°
H18C18C19H190.1°0.1°
H203C20H202H201117.5°120.0°
H213C21H212H211118.1°120.0°
C23C22H222H221116.1°120.0°
C22C23C29H23180.0°180.0°
C22C23C29H2920.0°179.9°
C22C23C29H291180.0°0.1°
H222C22C23C29113.6°115.0°
H222C22C23H2366.5°65.0°
H221C22C23C294.0°5.0°
H221C22C23H23176.0°175.1°
C23C29H292H291179.9°179.9°
H23C23C29H292179.9°0.1°
H23C23C29H2910.0°179.9°
C27C24H242H241116.4°120.0°
C24C27C28H27180.0°180.0°
C24C27C28H2820.0°180.0°
C24C27C28H281180.0°0.1°
H242C24C27C2810.9°115.0°
H242C24C27H27169.1°65.0°
H241C24C27C2898.6°5.1°
H241C24C27H2781.4°174.9°
H253C25H252H251117.5°120.0°
H263C26H262H261118.1°120.0°
C27C28H282H281180.0°179.9°
H27C27C28H282180.0°0.1°
H27C27C28H2810.0°179.9°

224931

PDB entries from 2024-09-11

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