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NB5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C24C13sing1.51Å1.48Å
C13N28doub1.32Å1.34ÅAromatic
C13N27sing1.32Å1.34ÅAromatic
N28C3sing1.32Å1.34ÅAromatic
C15C23sing1.53Å1.50Å
C15C16sing1.53Å1.50Å
N27C2doub1.32Å1.34ÅAromatic
C3C6doub1.40Å1.38ÅAromatic
C25C23sing1.53Å1.49Å
C23C16sing1.53Å1.50Å
C23O36sing1.43Å1.45Å
C2C6sing1.40Å1.38ÅAromatic
O36C12sing1.35Å1.40Å
C6C11sing1.48Å1.45Å
N30C11doub1.32Å1.34ÅAromatic
N30C8sing1.33Å1.34ÅAromatic
C11C10sing1.41Å1.38ÅAromatic
C12C8doub1.42Å1.38ÅAromatic
C12N32sing1.32Å1.33ÅAromatic
C8C7sing1.42Å1.38ÅAromatic
N32C14doub1.33Å1.33ÅAromatic
C10F37sing1.35Å1.33Å
C10C1doub1.37Å1.38ÅAromatic
C4N29doub1.31Å1.33ÅAromatic
C4C9sing1.40Å1.41ÅAromatic
N29N33sing1.40Å1.34ÅAromatic
C7C1sing1.41Å1.38ÅAromatic
C7N31doub1.34Å1.34ÅAromatic
C14N31sing1.32Å1.33ÅAromatic
C14N35sing1.38Å1.40Å
C9N35sing1.41Å1.36Å
C9C5doub1.36Å1.37ÅAromatic
N33C21sing1.47Å1.46Å
N33C5sing1.36Å1.37ÅAromatic
C21C17sing1.54Å1.54Å
C21C18sing1.54Å1.54Å
C17C22sing1.53Å1.53Å
C18C22sing1.53Å1.53Å
C19C22sing1.53Å1.53Å
C19N34sing1.48Å1.48Å
C22C20sing1.53Å1.53Å
N34C20sing1.48Å1.47Å
N34C26sing1.47Å1.46Å
C1H1sing1.08Å1.08Å
C2H2sing1.08Å1.08Å
C3H3sing1.08Å1.08Å
C15H4sing1.09Å1.10Å
C15H5sing1.09Å1.10Å
C16H6sing1.09Å1.10Å
C16H7sing1.09Å1.10Å
C19H8sing1.09Å1.10Å
C19H9sing1.09Å1.10Å
C20H10sing1.09Å1.10Å
C20H11sing1.09Å1.10Å
C21H12sing1.09Å1.10Å
C24H13sing1.09Å1.10Å
C24H14sing1.09Å1.10Å
C24H15sing1.09Å1.10Å
C4H16sing1.08Å1.08Å
C5H17sing1.08Å1.08Å
C17H18sing1.09Å1.10Å
C17H19sing1.09Å1.10Å
C18H20sing1.09Å1.10Å
C18H21sing1.09Å1.10Å
C25H22sing1.09Å1.10Å
C25H23sing1.09Å1.10Å
C25H24sing1.09Å1.10Å
C26H25sing1.09Å1.10Å
C26H26sing1.09Å1.10Å
C26H27sing1.09Å1.10Å
N35H29sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C24C13N28116.0°119.0°
C24C13N27116.7°119.0°
C13C24H13109.5°109.5°
C13C24H14109.5°109.5°
C13C24H15109.5°109.5°
N28C13N27127.4°122.0°
C13N28C3115.4°120.9°
C13N27C2114.1°121.0°
N28C3C6123.4°118.9°
N28C3H3118.3°120.5°
C23C15C1660.1°60.0°
C15C23C25116.7°117.5°
C15C23C1659.8°60.0°
C15C23O36113.5°117.5°
C23C15H4120.0°117.5°
C23C15H5120.0°117.5°
C15C16C2360.1°60.0°
C16C15H4120.0°117.5°
C16C15H5120.0°117.5°
C15C16H6120.0°117.5°
C15C16H7120.0°117.5°
N27C2C6124.5°118.9°
N27C2H2117.7°120.5°
C3C6C2115.1°118.2°
C3C6C11120.2°120.9°
C6C3H3118.3°120.6°
C25C23C16118.6°117.5°
C25C23O36116.0°115.6°
C23C25H22109.5°109.4°
C23C25H23109.5°109.5°
C23C25H24109.5°109.4°
C16C23O36119.7°117.5°
C23C16H6120.0°117.4°
C23C16H7120.0°117.5°
C23O36C12118.2°117.0°
C2C6C11124.5°120.9°
C6C2H2117.8°120.6°
O36C12C8117.3°120.8°
O36C12N32119.6°120.8°
C6C11N30114.6°119.3°
C6C11C10124.5°119.3°
C11N30C8117.9°121.2°
N30C11C10120.9°121.4°
N30C8C12121.3°121.7°
N30C8C7124.4°120.3°
C11C10F37121.6°120.1°
C11C10C1120.1°119.8°
C8C12N32123.2°118.4°
C12C8C7114.2°118.1°
C12N32C14118.7°121.6°
C8C7C1116.6°119.1°
C8C7N31123.4°119.0°
N32C14N31122.6°122.6°
N32C14N35118.4°118.7°
F37C10C1118.3°120.1°
C10C1C7119.8°118.2°
C10C1H1120.1°120.9°
N29C4C9111.9°108.4°
C4N29N33103.6°108.3°
N29C4H16124.1°125.8°
C4C9N35127.7°126.1°
C4C9C5105.2°107.8°
C9C4H16124.0°125.8°
N29N33C21118.4°126.0°
N29N33C5114.0°107.9°
C1C7N31120.0°121.9°
C7C1H1120.1°120.9°
C7N31C14117.9°120.4°
N31C14N35119.0°118.7°
C14N35C9126.1°120.0°
C14N35H29116.9°120.0°
N35C9C5127.1°126.1°
C9N35H29117.0°120.0°
C9C5N33105.2°107.6°
C9C5H17127.4°126.2°
C21N33C5127.5°126.1°
N33C21C17116.2°113.6°
N33C21C18118.9°113.6°
N33C21H12110.2°112.9°
N33C5H17127.4°126.2°
C17C21C1891.7°87.3°
C21C17C2285.7°86.8°
C17C21H12109.1°113.6°
C21C17H18115.0°113.6°
C21C17H19115.0°113.7°
C21C18C2285.6°86.8°
C18C21H12109.2°113.6°
C21C18H20115.1°113.7°
C21C18H21115.0°113.7°
C17C22C1892.3°88.2°
C17C22C19121.4°121.3°
C17C22C20117.2°121.3°
C22C17H18115.1°113.7°
C22C17H19115.1°113.7°
C18C22C19119.3°121.3°
C18C22C20121.5°121.3°
C22C18H20115.0°113.6°
C22C18H21115.1°113.7°
C22C19N3487.2°85.8°
C19C22C2088.2°87.4°
C22C19H8114.7°113.8°
C22C19H9114.7°113.8°
C19N34C2092.1°91.0°
C19N34C26109.6°111.0°
N34C19H8114.7°113.8°
N34C19H9114.7°113.9°
C22C20N3487.3°85.8°
C22C20H10114.7°113.8°
C22C20H11114.7°113.8°
C20N34C26107.8°111.0°
N34C20H10114.7°113.8°
N34C20H11114.7°113.9°
N34C26H25109.5°109.4°
N34C26H26109.5°109.5°
N34C26H27109.4°109.5°
H4C15H5109.4°115.6°
H6C16H7109.5°115.6°
H8C19H9109.5°113.1°
H10C20H11109.5°113.0°
H13C24H14109.5°109.4°
H13C24H15109.4°109.4°
H14C24H15109.5°109.5°
H18C17H19109.5°112.9°
H20C18H21109.5°112.9°
H22C25H23109.5°109.5°
H22C25H24109.5°109.5°
H23C25H24109.4°109.5°
H25C26H26109.5°109.5°
H25C26H27109.5°109.4°
H26C26H27109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C24C13N28N27179.5°179.1°
C24C13N28C3180.0°180.0°
C24C13N27C2179.2°179.7°
C13C24H13H14120.0°120.1°
C13C24H13H15120.0°120.0°
C13C24H14H15120.0°120.0°
N28C13N27C20.3°0.5°
C13N28C3C61.0°0.6°
C13N28C3H3179.0°179.5°
N28C13C24H130.0°90.0°
N28C13C24H14120.0°150.0°
N28C13C24H15120.0°30.0°
N27C13N28C30.5°0.9°
C13N27C2C60.7°0.0°
C13N27C2H2179.3°179.8°
N27C13C24H13179.5°90.8°
N27C13C24H1460.4°29.2°
N27C13C24H1559.5°149.2°
N28C3C6H3180.0°179.9°
N28C3C6C20.8°0.0°
N28C3C6C11177.8°180.0°
C23C15C16H4109.5°107.5°
C23C15C16H5109.5°107.4°
C15C23C25C1668.5°68.7°
C15C23C25O36137.9°145.7°
C15C23C16O36101.5°107.5°
C15C23O36C12146.5°65.4°
C23C15H4H5144.7°145.7°
C23C15C16H6109.5°107.4°
C23C15C16H7109.5°107.5°
C15C23C25H22180.0°65.0°
C15C23C25H2360.0°175.0°
C15C23C25H2460.0°55.0°
C16C15H4H5144.7°145.7°
C15C16H6H7144.7°145.7°
N27C2C6C30.2°0.3°
N27C2C6H2180.0°179.7°
N27C2C6C11176.7°179.7°
C3C6C2C11176.9°180.0°
C3C6C11N3036.3°145.0°
C3C6C11C10141.7°34.9°
C3C6C2H2179.8°180.0°
C25C23C16O36152.6°145.0°
C25C23O36C1274.3°80.3°
C25C23C15H40.4°145.0°
C25C23C15H5141.4°0.0°
C25C23C16H63.6°0.0°
C25C23C16H7144.5°145.1°
C23C25H22H23120.0°120.0°
C23C25H22H24120.0°119.9°
C23C25H23H24120.0°120.0°
C16C23O36C1279.0°134.0°
C23C16H6H7144.7°145.7°
C16C23C25H22111.5°3.6°
C16C23C25H23128.5°116.3°
C16C23C25H248.5°123.6°
C23O36C12C8173.4°175.0°
C23O36C12N326.8°5.1°
O36C23C15H4138.6°0.0°
O36C23C15H52.4°145.1°
O36C23C16H6149.0°145.0°
O36C23C16H78.0°0.0°
O36C23C25H2242.1°149.3°
O36C23C25H2377.9°29.3°
O36C23C25H24162.1°90.7°
C2C6C11N30140.5°35.0°
C2C6C11C1041.6°145.0°
C2C6C3H3179.2°180.0°
O36C12C8N301.1°0.1°
O36C12C8N32179.9°179.9°
O36C12C8C7178.5°179.9°
O36C12N32C14179.1°180.0°
C6C11N30C10178.0°180.0°
C6C11N30C8176.9°179.7°
C6C11C10F375.2°0.0°
C6C11C10C1174.3°180.0°
C11C6C2H23.3°0.0°
C11C6C3H32.2°0.1°
C11N30C8C12179.8°179.7°
C11N30C8C72.6°0.3°
N30C11C10F37177.0°180.0°
N30C11C10C13.5°0.0°
C8N30C11C101.1°0.3°
N30C8C12C7177.4°180.0°
N30C8C12N32178.8°180.0°
N30C8C7C13.6°0.0°
N30C8C7N31178.9°180.0°
C11C10F37C1179.5°179.9°
C11C10C1C72.4°0.3°
C11C10C1H1177.6°180.0°
C8C12N32C140.8°0.1°
C12C8C7C1179.0°180.0°
C12C8C7N311.6°0.0°
N32C12C8C71.4°0.0°
C12N32C14N310.2°0.0°
C12N32C14N35179.7°179.9°
C8C7C1C101.0°0.3°
C8C7C1N31177.5°180.0°
C8C7N31C141.1°0.1°
C8C7C1H1179.0°180.0°
N32C14N31C70.4°0.0°
N32C14N31N35179.9°180.0°
N32C14N35C96.0°180.0°
N32C14N35H29174.0°0.0°
F37C10C1C7178.1°179.7°
F37C10C1H11.9°0.0°
C10C1C7H1180.0°179.7°
C10C1C7N31178.6°179.7°
N29C4C9H16180.0°179.9°
N29C4C9N35179.3°180.0°
N29C4C9C50.0°0.2°
C4N29N33C21177.6°180.0°
C4N29N33C50.7°0.1°
C9C4N29N330.4°0.1°
C4C9N35C1419.7°0.2°
C4C9N35C5179.3°179.8°
C4C9C5N330.4°0.2°
C4C9C5H17179.6°179.8°
C4C9N35H29160.3°179.7°
N29N33C5C90.7°0.2°
N29N33C21C5176.5°179.9°
N29N33C21C17131.2°95.1°
N29N33C21C18120.7°167.3°
N29N33C21H126.4°36.1°
N33N29C4H16179.6°179.9°
N29N33C5H17179.3°179.8°
C1C7N31C14178.5°180.0°
C7N31C14N35179.5°180.0°
N31C7C1H11.5°0.0°
N31C14N35C9174.2°0.1°
N31C14N35H295.8°180.0°
C14N35C9H29180.0°180.0°
C14N35C9C5161.0°180.0°
N35C9C5N33179.0°180.0°
N35C9C4H160.7°0.0°
N35C9C5H171.0°0.0°
C9C5N33C21177.3°179.9°
C9C5N33H17180.0°180.0°
C5C9C4H16180.0°179.8°
C5C9N35H2919.0°0.0°
N33C21C17C18123.6°114.6°
N33C21C17H12125.4°130.8°
N33C21C18H12127.6°130.8°
N33C21C17C22139.9°89.9°
N33C21C18C22137.7°89.9°
C21N33C5H172.7°0.2°
N33C21C17H1824.2°24.6°
N33C21C17H19104.5°155.5°
N33C21C18H20106.7°155.6°
N33C21C18H2122.0°24.6°
C5N33C21C1745.2°85.0°
C5N33C21C1862.8°12.7°
C5N33C21H12170.1°143.9°
C17C21C18H12111.0°114.6°
C21C17C22H18115.7°114.4°
C21C17C22H19115.7°114.5°
C17C21C18C2216.2°24.6°
C21C17C22C19110.5°150.9°
C21C17C22C20143.8°101.2°
C21C17H18H19131.3°131.3°
C17C21C18H20131.8°89.8°
C17C21C18H2199.4°139.1°
C21C18C22H20115.7°114.5°
C21C18C22H21115.6°114.5°
C21C18C22C19112.1°150.9°
C21C18C22C20140.4°101.2°
C18C21C17H1899.5°139.1°
C18C21C17H19131.9°89.9°
C21C18H20H21131.4°131.4°
C17C22C18C19128.4°126.1°
C17C22C18C20124.1°126.1°
C17C22C19C20121.0°125.5°
C17C22C19N34104.3°102.3°
C17C22C20N34107.9°102.3°
C17C22C19H811.7°11.9°
C17C22C19H9139.8°143.4°
C17C22C20H10136.1°143.5°
C17C22C20H118.1°12.0°
C22C17C21H1294.8°139.3°
C22C17H18H19131.4°131.5°
C17C22C18H20132.0°89.6°
C17C22C18H2199.3°139.3°
C18C22C19C20125.5°125.5°
C18C22C19N34142.3°148.7°
C18C22C20N34140.5°148.7°
C18C22C19H8101.7°97.1°
C18C22C19H926.3°34.4°
C18C22C20H1024.5°34.5°
C18C22C20H11103.5°97.0°
C22C18C21H1294.8°139.2°
C18C22C17H1899.3°139.2°
C18C22C17H19132.0°89.7°
C22C18H20H21131.4°131.4°
C22C19N34H8116.0°114.2°
C22C19N34H9116.0°114.2°
C22C19N34C2017.4°23.9°
C22C19N34C26127.2°136.9°
C22C19H8H9130.6°131.9°
C19C22C20H1099.2°91.1°
C19C22C20H11132.9°137.5°
C19C22C17H18133.9°94.7°
C19C22C17H195.2°36.4°
C19C22C18H203.6°36.4°
C19C22C18H21132.3°94.6°
C19N34C20C26111.3°113.0°
N34C19H8H9130.6°131.9°
C19N34C20H1098.6°90.2°
C19N34C20H11133.4°138.2°
C19N34C26H25180.0°60.0°
C19N34C26H2660.0°180.0°
C19N34C26H2760.0°59.9°
C22C20N34H10116.0°114.2°
C22C20N34H11116.0°114.2°
C22C20N34C26128.8°136.9°
C20C22C19H8132.8°137.4°
C20C22C19H999.2°91.1°
C22C20H10H11130.5°131.8°
C20C22C17H1828.1°13.2°
C20C22C17H19100.6°144.3°
C20C22C18H20103.9°144.3°
C20C22C18H2124.8°13.3°
C20N34C19H8133.4°138.2°
C20N34C19H998.6°90.3°
N34C20H10H11130.6°132.1°
C20N34C26H2581.0°39.7°
C20N34C26H26159.0°80.3°
C20N34C26H2739.0°159.6°
C26N34C19H8116.8°108.8°
C26N34C19H911.2°22.7°
C26N34C20H1012.8°22.8°
C26N34C20H11115.2°108.9°
N34C26H25H26120.0°120.0°
N34C26H25H27120.0°120.0°
N34C26H26H27120.0°120.1°
H4C15C16H60.0°145.1°
H4C15C16H7141.0°0.0°
H5C15C16H6141.0°0.0°
H5C15C16H70.0°145.0°
H12C21C17H18149.5°106.2°
H12C21C17H1920.9°24.7°
H12C21C18H2020.9°24.8°
H12C21C18H21149.6°106.3°
H13C24H14H15119.9°119.9°
H22C25H23H24120.0°120.1°
H25C26H26H27120.0°120.0°

225399

PDB entries from 2024-09-25

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